data_2lkp_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 2lkp _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 38.1 m-20 . . . . . 0 C--O 1.238 0.471 0 CA-C-O 121.36 0.6 . . . . 0.0 111.088 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 96.7 p -55.88 -28.39 56.39 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.254 -179.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -70.91 -49.85 41.28 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.645 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -55.34 -41.29 72.29 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 -179.741 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.8 -53.81 48.51 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 120.493 -0.483 . . . . 0.0 110.317 179.408 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.06 -47.73 80.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.9 0.381 . . . . 0.0 110.995 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 18.5 mm100 -56.58 -51.14 69.75 Favored 'General case' 0 C--O 1.24 0.604 0 CA-C-O 121.304 0.573 . . . . 0.0 110.488 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 71.0 t -60.97 -43.12 95.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.814 179.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -50.83 -47.66 60.04 Favored 'General case' 0 C--O 1.223 -0.317 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.422 179.682 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 39.3 t -60.43 -43.15 97.08 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.084 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 21.7 m -63.34 -50.73 68.85 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.549 -0.46 . . . . 0.0 110.937 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 89.9 mt -70.13 -22.07 63.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.783 -179.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 55.3 tt0 -75.81 -55.1 5.96 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.661 178.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.48 -55.29 35.21 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 120.616 -0.434 . . . . 0.0 110.396 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.476 ' O ' ' O ' ' A' ' 31' ' ' ALA . 86.3 mt -45.99 -32.61 2.86 Favored 'General case' 0 CA--C 1.513 -0.447 0 C-N-CA 121.052 -0.259 . . . . 0.0 110.346 -179.202 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.476 ' O ' ' O ' ' A' ' 30' ' ' LEU . . . -58.08 -126.84 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.282 179.575 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.433 ' O ' ' O ' ' A' ' 31' ' ' ALA . 0.6 OUTLIER 54.04 108.22 0.02 OUTLIER Pre-proline 0 CA--C 1.539 0.52 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.482 -179.721 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -48.77 -58.22 1.88 Allowed 'Trans proline' 0 N--CA 1.496 1.639 0 C-N-CA 122.265 1.977 . . . . 0.0 113.257 -179.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 5.4 t -57.26 -45.4 84.03 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.823 -178.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 42.6 ttm180 -57.38 -44.05 84.12 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 120.806 -0.358 . . . . 0.0 110.778 -179.513 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 10.0 mt -62.64 -44.5 96.12 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.833 -0.347 . . . . 0.0 110.638 179.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 6.9 ttt -54.08 -48.77 70.31 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 120.371 -0.532 . . . . 0.0 110.222 179.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.413 HG23 HD13 ' A' ' 38' ' ' ILE . 47.8 mm -64.87 -43.03 96.37 Favored 'Isoleucine or valine' 0 C--O 1.236 0.39 0 CA-C-O 121.302 0.572 . . . . 0.0 110.528 179.387 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.8 tt -61.6 -43.96 97.88 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.15 -179.308 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 12.0 m -59.26 -43.22 92.48 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.913 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 57.4 tp60 -55.56 -50.09 70.98 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.58 -42.92 95.3 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.96 0.886 . . . . 0.0 110.255 -179.498 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.51 ' O ' ' NE ' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -45.11 -35.79 3.31 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.389 -178.886 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 89.1 m-20 -61.29 -40.99 96.19 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.274 -179.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 167.1 170.9 32.55 Favored Glycine 0 CA--C 1.528 0.87 0 C-N-CA 120.549 -0.834 . . . . 0.0 111.25 178.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -62.6 150.49 87.59 Favored 'Trans proline' 0 N--CA 1.493 1.5 0 C-N-CA 122.733 2.289 . . . . 0.0 112.174 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 2.0 pp -175.14 145.03 0.85 Allowed Pre-proline 0 N--CA 1.449 -0.485 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.712 178.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -72.31 168.53 23.95 Favored 'Trans proline' 0 N--CA 1.498 1.742 0 C-N-CA 122.748 2.299 . . . . 0.0 112.28 178.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.439 ' CG2' ' N ' ' A' ' 50' ' ' THR . 9.0 m -63.26 -41.41 92.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.819 0.818 . . . . 0.0 110.603 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.439 ' N ' ' CG2' ' A' ' 49' ' ' VAL . 10.8 m -55.35 -41.01 71.95 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 114.756 -1.111 . . . . 0.0 110.479 179.538 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 89.2 m-20 -72.2 -42.92 65.26 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.086 0.47 . . . . 0.0 110.76 179.036 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.1 tt -61.65 -36.14 79.94 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.088 -0.505 . . . . 0.0 109.91 -179.2 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.548 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -68.61 -48.51 63.92 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 116.175 -0.466 . . . . 0.0 109.854 179.818 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -53.15 -39.65 63.7 Favored 'General case' 0 C--O 1.232 0.166 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.392 179.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.47 -40.42 95.67 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.563 179.569 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 97.6 mt -89.89 -69.7 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.519 -0.227 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.362 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . 0.548 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 150.49 74.88 0.01 OUTLIER Glycine 0 CA--C 1.523 0.56 0 C-N-CA 120.869 -0.681 . . . . 0.0 111.677 179.421 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 34.2 ttm 61.27 77.01 0.35 Allowed 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.823 0.344 . . . . 0.0 110.968 179.036 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 88.1 mt-10 -150.29 21.57 0.84 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.694 179.653 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -60.44 -29.8 69.24 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.632 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 77.9 p -70.32 -45.91 65.27 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.641 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.415 ' O ' ' OE1' ' A' ' 66' ' ' GLN . . . -63.11 -32.06 73.35 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.926 179.79 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 77.1 t -69.18 -48.13 70.46 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.131 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.518 179.458 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.415 ' HG ' ' N ' ' A' ' 65' ' ' HIS . 78.2 p -57.75 -41.88 82.82 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.642 -0.423 . . . . 0.0 110.424 -179.728 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' HIS . . . . . 0.415 ' N ' ' HG ' ' A' ' 64' ' ' SER . 52.1 m80 -67.93 -43.67 78.61 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.945 179.606 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . 0.485 ' N ' ' OE1' ' A' ' 66' ' ' GLN . 0.7 OUTLIER -59.48 -51.62 69.09 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.022 0.439 . . . . 0.0 110.389 -179.242 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -61.51 -40.11 93.42 Favored 'General case' 0 CA--C 1.505 -0.761 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.267 -179.612 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -57.61 -44.84 85.77 Favored 'General case' 0 C--N 1.307 -1.28 0 CA-C-O 121.417 0.627 . . . . 0.0 110.446 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 90.3 t -62.29 -53.97 40.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 C-N-CA 120.248 -0.581 . . . . 0.0 110.012 -179.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.456 ' O ' ' O ' ' A' ' 74' ' ' GLY . 4.2 mm? -61.51 -31.74 71.76 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.093 0.473 . . . . 0.0 110.242 -179.791 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.665 HH12 ' H ' ' A' ' 78' ' ' GLY . 59.9 ttt85 -59.29 -41.83 89.86 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.262 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 99.2 m-20 -63.72 -37.43 87.33 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.159 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 5.8 mt -89.42 -7.08 55.89 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.458 -179.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . 0.634 ' C ' ' H ' ' A' ' 76' ' ' VAL . . . 89.56 -140.92 15.87 Favored Glycine 0 CA--C 1.521 0.43 0 N-CA-C 110.357 -1.097 . . . . 0.0 110.357 -179.814 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 38.2 mt 67.29 -29.47 0.15 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.727 0.298 . . . . 0.0 110.528 -179.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.634 ' H ' ' C ' ' A' ' 74' ' ' GLY . 3.3 m -134.34 156.67 40.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.148 179.486 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 54.7 t -137.7 146.99 26.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.367 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . 0.665 ' H ' HH12 ' A' ' 71' ' ' ARG . . . -121.47 140.92 14.25 Favored Glycine 0 C--N 1.335 0.514 0 N-CA-C 110.161 -1.176 . . . . 0.0 110.161 179.162 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 99.9 m-20 . . . . . 0 N--CA 1.466 0.345 0 CA-C-O 120.9 0.381 . . . . 0.0 110.384 -179.886 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 84.3 t . . . . . 0 N--CA 1.461 0.089 0 N-CA-C 110.24 -0.281 . . . . 0.0 110.24 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 80.7 m-85 -106.37 131.63 53.36 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.384 179.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 93.7 p -150.16 170.47 18.87 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-O 120.842 0.354 . . . . 0.0 110.191 -179.486 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.554 ' CD2' ' N ' ' A' ' 89' ' ' LEU . 3.5 mm? -72.31 148.02 45.79 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.537 -179.576 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 26.4 t80 -51.7 -47.46 63.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.187 -179.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.49 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 19.7 p-10 -153.49 179.19 9.03 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.703 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 81.3 p -76.57 -17.91 58.95 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.609 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . 0.435 ' CD2' ' C ' ' A' ' 93' ' ' HIS . 12.1 t-160 -38.83 -69.39 0.13 Allowed 'General case' 0 C--O 1.236 0.368 0 CA-C-O 121.015 0.436 . . . . 0.0 110.777 -179.884 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 83.0 t -51.59 -41.16 27.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.969 -179.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -56.85 -47.82 79.5 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.666 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 99.0 mm-40 -58.21 -47.81 82.33 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.122 -179.612 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 15.4 tp -59.38 -43.66 92.87 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.048 -179.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 87.1 mt -63.7 -40.37 96.62 Favored 'General case' 0 C--O 1.221 -0.427 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.433 179.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -59.02 -42.78 91.02 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.622 -179.486 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.516 ' O ' ' ND1' ' A' ' 104' ' ' HIS . 72.6 mm-40 -67.2 -48.69 67.13 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.786 -0.366 . . . . 0.0 110.764 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -64.88 -50.57 66.07 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.159 -179.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . 0.52 ' CG2' ' N ' ' A' ' 103' ' ' TYR . 0.3 OUTLIER -62.36 -45.93 97.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 C-N-CA 120.396 -0.522 . . . . 0.0 110.769 -178.687 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' TYR . . . . . 0.52 ' N ' ' CG2' ' A' ' 102' ' ' ILE . 75.3 t80 -63.01 -49.31 75.14 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.117 -178.678 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' HIS . . . . . 0.516 ' ND1' ' O ' ' A' ' 100' ' ' GLU . 23.6 m80 -63.34 -37.22 86.41 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.737 -179.84 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 5.0 t -74.95 -44.07 50.58 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.946 0.403 . . . . 0.0 111.261 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 10.2 tm-20 -69.39 -21.59 63.77 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.566 -179.636 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . 0.476 ' C ' ' HD1' ' A' ' 107' ' ' HIS . 0.3 OUTLIER . . . . . 0 N--CA 1.452 -0.333 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.344 -179.091 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 36.3 m-20 . . . . . 0 C--O 1.238 0.47 0 CA-C-O 121.283 0.563 . . . . 0.0 110.991 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 92.1 p -57.21 -28.72 63.13 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.333 -179.584 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 10.3 tp-100 -70.66 -49.59 45.68 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.66 179.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 138' ' ' ALA . . . . . . . . . . . . . . . -55.69 -40.28 72.14 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 120.705 -0.398 . . . . 0.0 109.93 -179.614 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -63.07 -53.41 54.05 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 120.547 -0.461 . . . . 0.0 110.237 179.21 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -57.24 -47.5 81.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.867 0.365 . . . . 0.0 110.86 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 20.3 mm100 -55.99 -50.98 69.34 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-O 121.278 0.561 . . . . 0.0 110.452 -179.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 142' ' ' VAL . . . . . . . . . . . . . 76.5 t -61.96 -42.95 96.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.864 179.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -50.23 -48.6 54.4 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.269 179.561 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 38.1 t -60.42 -43.53 96.67 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.168 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 27.5 m -62.57 -50.48 71.13 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 120.556 -0.458 . . . . 0.0 111.026 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 91.3 mt -70.53 -21.6 62.71 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.901 -179.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 147' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -75.24 -56.98 4.18 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.561 179.144 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -59.65 -54.69 43.52 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.441 -179.454 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.487 ' O ' ' O ' ' B' ' 150' ' ' ALA . 81.0 mt -45.74 -34.5 3.65 Favored 'General case' 0 CA--C 1.514 -0.437 0 C-N-CA 120.976 -0.29 . . . . 0.0 110.455 -178.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 150' ' ' ALA . . . . . 0.487 ' O ' ' O ' ' B' ' 149' ' ' LEU . . . -57.57 -126.04 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.225 179.582 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 151' ' ' THR . . . . . 0.435 ' O ' ' O ' ' B' ' 150' ' ' ALA . 0.6 OUTLIER 54.35 108.22 0.02 OUTLIER Pre-proline 0 C--N 1.323 -0.579 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.49 -179.596 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_exo -48.26 -60.05 1.02 Allowed 'Trans proline' 0 N--CA 1.495 1.569 0 C-N-CA 122.256 1.97 . . . . 0.0 113.389 -179.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 39.8 t -56.64 -45.3 81.68 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.825 -178.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 42.0 ttm180 -57.17 -43.5 82.65 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 120.796 -0.362 . . . . 0.0 110.624 -179.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 155' ' ' LEU . . . . . . . . . . . . . 10.0 mt -63.1 -44.22 96.3 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.809 -0.357 . . . . 0.0 110.642 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 6.3 ttt -53.69 -48.76 69.22 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.358 -0.537 . . . . 0.0 110.158 179.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 41.8 mm -64.87 -43.43 96.33 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 CA-C-O 121.278 0.561 . . . . 0.0 110.524 179.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 1.7 tt -61.48 -43.5 98.76 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.064 -179.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 17.6 m -59.38 -43.51 92.88 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.033 -0.531 . . . . 0.0 109.996 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 61.3 tp60 -55.89 -49.97 71.93 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 120.483 -0.487 . . . . 0.0 109.811 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 161' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.31 -41.83 96.63 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.733 0.778 . . . . 0.0 110.159 -179.454 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 162' ' ' ARG . . . . . 0.532 ' NE ' ' O ' ' B' ' 162' ' ' ARG . 0.0 OUTLIER -45.56 -36.4 4.63 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.261 -179.006 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -60.99 -41.64 96.89 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.214 -179.609 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . 167.61 171.85 34.05 Favored Glycine 0 CA--C 1.528 0.862 0 C-N-CA 120.582 -0.818 . . . . 0.0 111.341 178.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_exo -64.12 150.84 87.51 Favored 'Trans proline' 0 N--CA 1.494 1.508 0 C-N-CA 122.836 2.357 . . . . 0.0 112.215 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 1.8 pp -174.85 146.46 1.0 Allowed Pre-proline 0 C--N 1.326 -0.455 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.753 178.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -71.74 166.83 28.27 Favored 'Trans proline' 0 N--CA 1.495 1.614 0 C-N-CA 122.831 2.354 . . . . 0.0 112.316 178.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 168' ' ' VAL . . . . . 0.441 ' CG2' ' N ' ' B' ' 169' ' ' THR . 10.1 m -62.32 -40.9 89.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.83 0.824 . . . . 0.0 110.636 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 169' ' ' THR . . . . . 0.441 ' N ' ' CG2' ' B' ' 168' ' ' VAL . 7.4 m -56.83 -38.8 73.13 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 114.745 -1.116 . . . . 0.0 110.294 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 27.5 m-20 -71.7 -44.33 64.39 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.201 0.524 . . . . 0.0 110.335 179.346 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.06 -32.54 72.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.16 -179.498 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 172' ' ' ALA . . . . . 0.541 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -70.99 -50.09 38.13 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.86 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -52.83 -38.82 61.86 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 120.515 -0.474 . . . . 0.0 110.336 179.607 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -64.76 -41.66 95.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.64 179.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 96.7 mt -89.4 -68.94 0.64 Allowed 'Isoleucine or valine' 0 CA--C 1.521 -0.139 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.329 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 176' ' ' GLY . . . . . 0.541 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 150.18 74.38 0.01 OUTLIER Glycine 0 CA--C 1.523 0.587 0 C-N-CA 120.959 -0.639 . . . . 0.0 111.633 179.373 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 33.4 ttm 61.38 78.15 0.3 Allowed 'General case' 0 C--O 1.232 0.148 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.866 179.293 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 88.2 mt-10 -150.56 23.09 0.8 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.628 179.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -61.78 -29.24 70.01 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.452 179.808 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 180' ' ' SER . . . . . 0.446 ' O ' ' ND1' ' B' ' 184' ' ' HIS . 78.3 p -70.28 -46.74 63.72 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.891 0.377 . . . . 0.0 110.463 -179.527 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 181' ' ' ALA . . . . . 0.409 ' O ' ' OE1' ' B' ' 185' ' ' GLN . . . -63.56 -30.97 72.01 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.931 179.691 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 54.2 t -69.34 -49.32 61.59 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.199 0 CA-C-O 121.135 0.493 . . . . 0.0 110.688 179.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 183' ' ' SER . . . . . 0.474 ' HG ' ' N ' ' B' ' 184' ' ' HIS . 78.9 p -58.56 -40.61 83.53 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.653 -0.419 . . . . 0.0 110.463 -179.642 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 184' ' ' HIS . . . . . 0.474 ' N ' ' HG ' ' B' ' 183' ' ' SER . 51.4 m80 -67.92 -43.18 79.8 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.983 179.703 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 185' ' ' GLN . . . . . 0.476 ' N ' ' OE1' ' B' ' 185' ' ' GLN . 0.7 OUTLIER -60.49 -51.37 69.74 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.038 0.447 . . . . 0.0 110.491 -179.247 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -61.59 -39.65 91.97 Favored 'General case' 0 CA--C 1.506 -0.748 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.007 -179.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 15.1 tpt180 -57.91 -45.19 86.86 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-O 121.495 0.664 . . . . 0.0 110.46 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 73.9 t -62.21 -53.67 44.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 C-N-CA 120.159 -0.617 . . . . 0.0 109.96 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 189' ' ' LEU . . . . . 0.455 ' O ' ' O ' ' B' ' 193' ' ' GLY . 4.3 mm? -61.04 -31.88 71.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.09 0.472 . . . . 0.0 110.155 -179.751 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 190' ' ' ARG . . . . . 0.721 HH12 ' H ' ' B' ' 197' ' ' GLY . 60.4 ttt85 -59.61 -41.97 91.58 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.331 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 -63.57 -37.02 85.75 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 120.734 -0.386 . . . . 0.0 110.346 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 192' ' ' LEU . . . . . . . . . . . . . 5.7 mt -89.56 -8.78 51.97 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.612 -179.364 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 193' ' ' GLY . . . . . 0.618 ' C ' ' H ' ' B' ' 195' ' ' VAL . . . 91.8 -141.72 15.75 Favored Glycine 0 CA--C 1.52 0.365 0 N-CA-C 110.389 -1.084 . . . . 0.0 110.389 -179.787 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 30.6 mt 67.86 -29.82 0.16 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.759 0.314 . . . . 0.0 110.613 -179.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 195' ' ' VAL . . . . . 0.618 ' H ' ' C ' ' B' ' 193' ' ' GLY . 3.1 m -136.18 158.34 38.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.29 179.735 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 196' ' ' VAL . . . . . . . . . . . . . 77.5 t -140.99 153.7 20.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.318 179.257 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 197' ' ' GLY . . . . . 0.721 ' H ' HH12 ' B' ' 190' ' ' ARG . . . -126.04 144.17 14.92 Favored Glycine 0 N--CA 1.464 0.505 0 N-CA-C 110.362 -1.095 . . . . 0.0 110.362 179.614 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 33.9 m-20 . . . . . 0 N--CA 1.465 0.316 0 CA-C-O 120.89 0.376 . . . . 0.0 110.614 179.904 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 96.6 t . . . . . 0 C--O 1.228 -0.073 0 N-CA-C 110.151 -0.314 . . . . 0.0 110.151 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -106.92 132.52 52.78 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.418 179.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 51.5 p -151.36 171.36 17.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.281 -179.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 208' ' ' LEU . . . . . 0.557 ' CD2' ' N ' ' B' ' 208' ' ' LEU . 3.5 mm? -73.62 148.52 42.78 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.814 -179.692 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 23.4 t80 -51.63 -47.81 63.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.271 -179.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 210' ' ' ASP . . . . . 0.518 ' N ' ' OD1' ' B' ' 210' ' ' ASP . 14.3 p-10 -153.07 -179.46 7.71 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.809 0.338 . . . . 0.0 110.655 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 65.1 p -77.81 -16.94 57.97 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.531 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 212' ' ' HIS . . . . . 0.412 ' NE2' ' CB ' ' A' ' 104' ' ' HIS . 11.9 t-160 -39.4 -69.63 0.12 Allowed 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.079 0.466 . . . . 0.0 110.831 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 87.0 t -50.75 -41.56 21.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.924 -179.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 214' ' ' ALA . . . . . . . . . . . . . . . -57.34 -47.2 82.19 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.918 0.389 . . . . 0.0 110.813 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -57.98 -47.39 83.13 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.138 -179.538 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 216' ' ' LEU . . . . . . . . . . . . . 14.1 tp -60.62 -43.56 97.36 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 120.449 -0.501 . . . . 0.0 110.049 -179.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 86.6 mt -63.56 -39.94 95.68 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.439 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -59.66 -42.08 92.02 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.487 -179.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 219' ' ' GLU . . . . . 0.459 ' O ' ' ND1' ' B' ' 223' ' ' HIS . 70.8 mm-40 -67.72 -49.2 63.86 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.796 -0.361 . . . . 0.0 110.742 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -63.89 -51.3 65.16 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.986 -179.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 221' ' ' ILE . . . . . 0.508 ' CG2' ' N ' ' B' ' 222' ' ' TYR . 0.2 OUTLIER -62.26 -45.91 97.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 C-N-CA 120.419 -0.512 . . . . 0.0 110.667 -178.587 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 222' ' ' TYR . . . . . 0.508 ' N ' ' CG2' ' B' ' 221' ' ' ILE . 77.1 t80 -62.52 -49.29 75.95 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.06 -178.489 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 223' ' ' HIS . . . . . 0.459 ' ND1' ' O ' ' B' ' 219' ' ' GLU . 23.8 m80 -63.76 -36.54 84.21 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.737 -179.849 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 5.6 t -75.04 -44.66 46.5 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.927 0.394 . . . . 0.0 111.354 179.792 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 11.5 tm-20 -69.58 -21.67 63.59 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.596 -179.598 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.452 -0.346 0 C-N-CA 120.581 -0.448 . . . . 0.0 110.458 -179.145 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 . . . . . 0 C--O 1.234 0.245 0 CA-C-O 120.787 0.327 . . . . 0.0 110.927 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 11.9 t -58.22 -50.01 75.08 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.818 179.439 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -61.41 -43.13 99.4 Favored 'General case' 0 C--O 1.221 -0.407 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.393 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -55.3 -41.33 72.2 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.296 -179.714 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.05 -54.8 21.29 Favored 'General case' 0 C--N 1.333 -0.126 0 C-N-CA 120.672 -0.411 . . . . 0.0 110.835 179.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -58.58 -50.52 73.51 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.933 179.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.415 ' OE1' ' OG ' ' B' ' 224' ' ' SER . 54.5 tt0 -53.63 -50.69 65.15 Favored 'General case' 0 C--O 1.244 0.767 0 CA-C-O 121.061 0.458 . . . . 0.0 110.502 -179.766 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.486 ' O ' ' OG1' ' A' ' 26' ' ' THR . 49.1 t -61.5 -43.62 97.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.071 -0.513 . . . . 0.0 109.818 179.271 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -53.49 -47.24 70.0 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.308 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 41.1 t -58.71 -43.66 90.17 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.508 -179.275 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.486 ' OG1' ' O ' ' A' ' 23' ' ' VAL . 12.7 p -65.45 -53.81 37.47 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 120.602 -0.439 . . . . 0.0 111.216 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.433 ' N ' ' CD1' ' A' ' 27' ' ' LEU . 8.0 mp -65.44 -23.13 66.86 Favored 'General case' 0 C--O 1.222 -0.39 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.941 -179.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 46.6 tt0 -73.11 -63.8 1.1 Allowed 'General case' 0 C--N 1.32 -0.682 0 O-C-N 123.39 0.431 . . . . 0.0 110.588 -179.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.442 ' O ' ' OG1' ' A' ' 32' ' ' THR . . . -54.94 -52.45 62.94 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.905 -179.111 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.405 ' O ' ' C ' ' A' ' 31' ' ' ALA . 4.1 mm? -53.44 -40.0 64.84 Favored 'General case' 0 CA--C 1.512 -0.516 0 C-N-CA 120.701 -0.399 . . . . 0.0 110.917 -179.636 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.587 ' O ' ' C ' ' A' ' 32' ' ' THR . . . -38.76 -73.1 0.05 Allowed 'General case' 0 CA--C 1.51 -0.59 0 O-C-N 123.637 0.585 . . . . 0.0 110.309 179.916 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.587 ' C ' ' O ' ' A' ' 31' ' ' ALA . 6.0 p -4.53 110.99 0.03 OUTLIER Pre-proline 0 CA--C 1.54 0.56 0 O-C-N 124.294 0.996 . . . . 0.0 111.134 179.241 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_exo -50.11 -45.52 32.81 Favored 'Trans proline' 0 C--N 1.303 -1.843 0 C-N-CA 122.231 1.954 . . . . 0.0 112.45 -177.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 66.7 m -56.98 -44.82 83.05 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.982 -179.105 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 77.6 mmt-85 -63.31 -38.32 90.7 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.063 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.424 ' CD1' ' O ' ' A' ' 31' ' ' ALA . 93.9 mt -64.66 -54.2 35.49 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.682 -0.407 . . . . 0.0 111.14 -179.614 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 10.7 tpt -54.34 -49.44 69.73 Favored 'General case' 0 C--O 1.239 0.539 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.394 -179.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 5.3 mm -62.77 -44.19 99.32 Favored 'Isoleucine or valine' 0 C--O 1.243 0.742 0 CA-C-O 121.22 0.533 . . . . 0.0 110.832 179.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 27.1 mt -61.41 -39.23 89.97 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.165 179.602 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 18.9 m -58.83 -40.37 83.99 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 179.554 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -60.55 -44.54 96.03 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 121.072 0.463 . . . . 0.0 110.077 179.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.497 ' O ' ' N ' ' A' ' 44' ' ' ASN . 13.8 mt -63.45 -37.94 89.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.746 179.158 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.425 ' C ' ' O ' ' A' ' 42' ' ' LEU . 77.4 ttt-85 -35.76 -30.04 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.482 -178.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.497 ' N ' ' O ' ' A' ' 42' ' ' LEU . 98.8 m-20 -65.34 -48.69 72.13 Favored 'General case' 0 C--N 1.334 -0.092 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.803 179.476 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.493 ' N ' ' O ' ' A' ' 42' ' ' LEU . . . 152.45 -79.52 0.2 Allowed Glycine 0 CA--C 1.528 0.863 0 N-CA-C 110.717 -0.953 . . . . 0.0 110.717 179.827 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -70.21 -172.88 0.67 Allowed 'Trans proline' 0 C--N 1.306 -1.692 0 C-N-CA 122.699 2.266 . . . . 0.0 111.937 179.513 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 6.8 tp -140.24 70.14 33.82 Favored Pre-proline 0 N--CA 1.454 -0.249 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.21 179.061 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_exo -62.42 91.73 0.13 Allowed 'Trans proline' 0 C--N 1.303 -1.839 0 C-N-CA 122.816 2.344 . . . . 0.0 110.973 177.442 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 55.0 t -55.91 -53.18 41.06 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 C-N-CA 120.639 -0.424 . . . . 0.0 111.62 -179.019 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.53 ' HG1' ' H ' ' A' ' 51' ' ' ASP . 29.0 p -63.07 -63.32 1.23 Allowed 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 120.894 0.378 . . . . 0.0 110.917 179.937 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.53 ' H ' ' HG1' ' A' ' 50' ' ' THR . 0.3 OUTLIER -46.14 -47.13 17.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.325 -178.723 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 68.1 mt -62.71 -38.62 91.16 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.582 179.184 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -54.13 -50.98 65.69 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.494 179.716 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.476 ' OE1' ' O ' ' A' ' 50' ' ' THR . 7.7 mp0 -63.77 -38.44 91.11 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.357 179.78 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -57.21 -61.37 2.51 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 120.365 -0.534 . . . . 0.0 111.326 -179.125 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 15.0 pt -156.89 -10.28 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.731 -179.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -61.23 -55.43 29.39 Favored Glycine 0 C--N 1.335 0.526 0 N-CA-C 110.924 -0.87 . . . . 0.0 110.924 -178.727 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 78.9 mtp 45.55 25.82 0.27 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.684 0.278 . . . . 0.0 110.475 179.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.451 ' HG2' ' H ' ' A' ' 62' ' ' ALA . 73.2 tt0 -171.73 84.5 0.08 Allowed 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 109.77 -0.455 . . . . 0.0 109.77 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -63.7 -30.38 71.49 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.249 -179.204 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 35.5 t -64.14 -36.3 83.59 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.503 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.451 ' H ' ' HG2' ' A' ' 59' ' ' GLU . . . -67.71 -33.59 75.2 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.657 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 73.6 t -73.06 -52.84 20.42 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.919 -179.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 77.4 p -58.7 -44.58 90.38 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.316 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -62.78 -50.42 71.11 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.545 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 32.5 tt0 -60.9 -39.71 90.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.395 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 48.8 tp -61.12 -43.42 98.9 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.331 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -61.51 -40.59 95.17 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.403 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 97.9 t -61.7 -54.67 31.69 Favored 'Isoleucine or valine' 0 N--CA 1.46 0.069 0 C-N-CA 120.208 -0.597 . . . . 0.0 110.398 -179.479 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 10.9 mp -61.84 -33.79 74.79 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 179.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 26.2 tpt85 -58.4 -41.91 85.98 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.356 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 99.8 m-20 -60.72 -44.15 96.97 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.238 -179.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 10.3 mt -63.87 -40.16 95.89 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.223 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 103.94 19.27 12.07 Favored Glycine 0 CA--C 1.522 0.529 0 N-CA-C 110.869 -0.893 . . . . 0.0 110.869 -179.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.3 tp -80.54 -6.01 57.59 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.034 0.445 . . . . 0.0 110.694 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 34.6 m -139.27 163.26 26.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.298 -179.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.502 ' CG1' ' N ' ' A' ' 78' ' ' GLY . 77.7 t -149.49 164.43 3.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.789 179.867 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . 0.502 ' N ' ' CG1' ' A' ' 77' ' ' VAL . . . -107.65 147.05 16.32 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 110.445 -1.062 . . . . 0.0 110.445 179.374 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 . . . . . 0 N--CA 1.466 0.353 0 CA-C-O 120.762 0.315 . . . . 0.0 110.771 -179.931 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 29.3 m . . . . . 0 C--O 1.224 -0.254 0 CA-C-O 120.773 0.321 . . . . 0.0 110.605 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 78.4 m-85 -98.09 131.99 44.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.3 -179.429 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 66.0 p -145.49 166.74 24.8 Favored 'General case' 0 C--O 1.224 -0.243 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.142 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 44.8 mt -65.79 145.0 56.51 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.556 -179.607 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 12.7 t80 -50.47 -47.09 57.19 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.403 -179.511 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 23.6 p30 -141.69 169.73 17.04 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.861 0.362 . . . . 0.0 110.454 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -85.71 -16.88 37.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.476 -179.756 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 -45.43 -65.02 0.6 Allowed 'General case' 0 C--O 1.237 0.429 0 CA-C-O 120.984 0.421 . . . . 0.0 110.589 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 12.5 p -48.0 -36.63 5.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.303 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.35 -37.64 88.24 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.241 179.452 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 66.5 tp60 -62.51 -47.28 84.65 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-O 121.275 0.56 . . . . 0.0 109.935 -179.595 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.524 ' N ' ' CD1' ' A' ' 97' ' ' LEU . 7.1 mp -61.56 -42.75 99.3 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 120.424 -0.511 . . . . 0.0 110.214 -179.473 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 93.8 mt -66.97 -35.25 79.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.267 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 36.3 m-20 -60.78 -42.39 97.43 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.29 -0.413 . . . . 0.0 109.993 -179.408 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.479 ' O ' ' ND1' ' A' ' 104' ' ' HIS . 82.7 mt-10 -70.43 -52.81 19.56 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.383 179.197 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -55.44 -45.81 76.79 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.627 179.563 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 5.1 mm -63.57 -44.92 98.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.87 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 89.6 t80 -63.96 -47.02 82.09 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.145 0.497 . . . . 0.0 110.61 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' HIS . . . . . 0.479 ' ND1' ' O ' ' A' ' 100' ' ' GLU . 51.8 m80 -60.62 -36.09 77.76 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.472 -179.735 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.421 ' OG ' ' OE1' ' B' ' 141' ' ' GLN . 38.9 t -76.52 -46.88 24.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.873 179.562 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -55.59 -28.21 53.77 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.359 -179.635 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 52.8 t-80 . . . . . 0 C--N 1.33 -0.25 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.685 179.708 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 . . . . . 0 C--O 1.238 0.476 0 CA-C-O 121.279 0.561 . . . . 0.0 110.591 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 11.4 t -59.26 -41.35 88.59 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.248 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -64.86 -46.28 82.51 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.44 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 138' ' ' ALA . . . . . . . . . . . . . . . -54.5 -41.56 69.75 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.183 -179.665 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -66.14 -54.3 27.17 Favored 'General case' 0 N--CA 1.457 -0.112 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.897 179.476 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -58.38 -51.27 70.54 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.976 179.594 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 141' ' ' GLN . . . . . 0.421 ' OE1' ' OG ' ' A' ' 105' ' ' SER . 57.1 tt0 -53.43 -49.86 66.44 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-O 121.084 0.469 . . . . 0.0 110.385 -179.747 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 142' ' ' VAL . . . . . 0.458 ' O ' ' OG1' ' B' ' 145' ' ' THR . 51.2 t -61.66 -43.25 96.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.699 179.186 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -54.44 -46.52 73.28 Favored 'General case' 0 C--O 1.217 -0.62 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.307 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 40.0 t -59.01 -44.01 91.64 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.508 -179.256 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 145' ' ' THR . . . . . 0.458 ' OG1' ' O ' ' B' ' 142' ' ' VAL . 18.0 p -65.51 -53.8 37.26 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 120.619 -0.432 . . . . 0.0 111.216 179.875 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 146' ' ' LEU . . . . . 0.415 ' N ' ' CD1' ' B' ' 146' ' ' LEU . 8.2 mp -65.04 -23.11 67.09 Favored 'General case' 0 C--O 1.22 -0.453 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.016 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 147' ' ' GLN . . . . . . . . . . . . . 46.5 tt0 -73.66 -63.35 1.22 Allowed 'General case' 0 C--N 1.319 -0.741 0 O-C-N 123.364 0.415 . . . . 0.0 110.498 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 148' ' ' ALA . . . . . 0.42 ' O ' ' OG1' ' B' ' 151' ' ' THR . . . -55.19 -52.92 61.8 Favored 'General case' 0 CA--C 1.521 -0.153 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.01 -179.085 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.411 ' O ' ' C ' ' B' ' 150' ' ' ALA . 4.1 mm? -52.96 -39.87 63.27 Favored 'General case' 0 CA--C 1.514 -0.429 0 C-N-CA 120.661 -0.415 . . . . 0.0 110.943 -179.773 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 150' ' ' ALA . . . . . 0.58 ' O ' ' C ' ' B' ' 151' ' ' THR . . . -39.19 -72.87 0.05 Allowed 'General case' 0 CA--C 1.511 -0.557 0 O-C-N 123.649 0.593 . . . . 0.0 110.285 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 151' ' ' THR . . . . . 0.58 ' C ' ' O ' ' B' ' 150' ' ' ALA . 6.8 p -4.77 110.3 0.03 OUTLIER Pre-proline 0 CA--C 1.54 0.582 0 O-C-N 124.279 0.987 . . . . 0.0 111.097 179.292 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_exo -49.4 -45.08 32.05 Favored 'Trans proline' 0 C--N 1.302 -1.875 0 C-N-CA 122.192 1.928 . . . . 0.0 112.487 -177.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 53.5 m -57.3 -44.85 84.45 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.983 -179.128 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 154' ' ' ARG . . . . . 0.585 ' NH1' HE21 ' B' ' 185' ' ' GLN . 77.2 mmt-85 -63.16 -39.01 93.42 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.996 -179.704 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 155' ' ' LEU . . . . . 0.414 ' CD1' ' O ' ' B' ' 150' ' ' ALA . 94.4 mt -63.86 -54.41 35.27 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 120.733 -0.387 . . . . 0.0 111.102 -179.559 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 10.8 tpt -54.48 -49.65 69.61 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.489 -0.484 . . . . 0.0 110.461 -179.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 5.0 mm -62.21 -44.36 99.01 Favored 'Isoleucine or valine' 0 C--O 1.242 0.686 0 CA-C-O 121.328 0.585 . . . . 0.0 110.764 179.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 27.5 mt -61.81 -39.32 91.33 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.109 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 99.8 m -58.5 -40.64 83.39 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 179.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -60.73 -44.24 96.9 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 120.968 0.414 . . . . 0.0 109.927 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 161' ' ' LEU . . . . . 0.476 ' O ' ' N ' ' B' ' 163' ' ' ASN . 14.2 mt -63.72 -36.31 83.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.852 179.219 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 162' ' ' ARG . . . . . 0.421 ' C ' ' O ' ' B' ' 161' ' ' LEU . 77.4 ttt-85 -36.48 -30.63 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.471 -179.104 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 163' ' ' ASN . . . . . 0.476 ' N ' ' O ' ' B' ' 161' ' ' LEU . 96.4 m-20 -64.96 -50.25 67.15 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.834 179.81 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 164' ' ' GLY . . . . . 0.449 ' N ' ' O ' ' B' ' 161' ' ' LEU . . . 153.91 -78.01 0.2 Allowed Glycine 0 CA--C 1.528 0.891 0 N-CA-C 110.682 -0.967 . . . . 0.0 110.682 179.715 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -70.71 -171.43 0.55 Allowed 'Trans proline' 0 C--N 1.306 -1.709 0 C-N-CA 122.681 2.254 . . . . 0.0 111.96 179.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 8.7 tp -142.25 69.9 22.34 Favored Pre-proline 0 C--N 1.331 -0.217 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.084 179.208 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_exo -63.02 91.83 0.14 Allowed 'Trans proline' 0 C--N 1.303 -1.863 0 C-N-CA 122.903 2.402 . . . . 0.0 111.123 177.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . 71.0 t -55.47 -53.29 37.62 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 C-N-CA 120.629 -0.429 . . . . 0.0 111.788 -178.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 169' ' ' THR . . . . . 0.674 ' HG1' ' H ' ' B' ' 170' ' ' ASP . 23.5 p -63.01 -63.1 1.3 Allowed 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.16 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 170' ' ' ASP . . . . . 0.674 ' H ' ' HG1' ' B' ' 169' ' ' THR . 0.8 OUTLIER -48.02 -44.97 31.44 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.159 -0.473 . . . . 0.0 109.966 -177.96 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 64.5 mt -63.52 -39.79 95.36 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.681 178.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 172' ' ' ALA . . . . . . . . . . . . . . . -53.31 -50.57 64.66 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.355 179.557 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 173' ' ' GLU . . . . . 0.476 ' OE1' ' O ' ' B' ' 169' ' ' THR . 8.7 mp0 -63.51 -38.86 92.77 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.382 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -56.76 -61.86 2.14 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 120.364 -0.534 . . . . 0.0 111.23 -179.077 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 15.5 pt -156.63 -9.76 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.752 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . -61.51 -55.12 30.7 Favored Glycine 0 CA--C 1.521 0.467 0 N-CA-C 110.94 -0.864 . . . . 0.0 110.94 -178.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 76.5 mtp 45.43 26.37 0.29 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.706 0.288 . . . . 0.0 110.402 179.193 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 178' ' ' GLU . . . . . 0.412 ' HG2' ' H ' ' B' ' 181' ' ' ALA . 70.2 tt0 -172.6 85.34 0.06 Allowed 'General case' 0 CA--C 1.528 0.103 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -179.91 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -64.21 -29.84 70.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.289 -179.252 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 38.4 t -64.07 -37.74 88.54 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.534 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 181' ' ' ALA . . . . . 0.412 ' H ' ' HG2' ' B' ' 178' ' ' GLU . . . -66.71 -33.27 75.26 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.683 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 74.8 t -73.36 -53.05 19.22 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.15 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.866 -179.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 78.0 p -59.34 -44.03 92.7 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 -179.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 58.9 t-80 -63.9 -50.38 68.97 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-O 120.935 0.398 . . . . 0.0 110.653 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 185' ' ' GLN . . . . . 0.585 HE21 ' NH1' ' B' ' 154' ' ' ARG . 40.4 tt0 -61.27 -39.83 91.85 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.106 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 53.6 tp -60.92 -45.14 95.84 Favored 'General case' 0 C--O 1.222 -0.372 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.305 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -59.79 -41.66 91.67 Favored 'General case' 0 C--O 1.241 0.646 0 O-C-N 123.212 0.32 . . . . 0.0 110.415 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 88.1 t -59.26 -54.05 39.64 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.096 0 C-N-CA 120.241 -0.583 . . . . 0.0 110.076 -179.357 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 10.8 mp -62.13 -33.05 73.76 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.927 -0.398 . . . . 0.0 109.927 179.503 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -57.76 -41.41 81.88 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.26 -179.411 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -63.1 -40.48 97.77 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.425 -179.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 192' ' ' LEU . . . . . . . . . . . . . 9.1 mt -66.27 -40.12 89.9 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.469 -179.489 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 103.44 17.13 18.41 Favored Glycine 0 CA--C 1.523 0.561 0 N-CA-C 110.923 -0.871 . . . . 0.0 110.923 -179.587 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 4.5 tp -80.24 -6.16 57.4 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.965 0.412 . . . . 0.0 110.656 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 34.3 m -138.67 162.5 29.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.33 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 196' ' ' VAL . . . . . 0.503 ' CG1' ' N ' ' B' ' 197' ' ' GLY . 71.3 t -149.28 164.16 4.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 120.905 0.384 . . . . 0.0 110.787 179.777 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 197' ' ' GLY . . . . . 0.503 ' N ' ' CG1' ' B' ' 196' ' ' VAL . . . -106.92 147.47 16.22 Favored Glycine 0 CA--C 1.523 0.575 0 N-CA-C 110.428 -1.069 . . . . 0.0 110.428 179.413 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 96.7 m-20 . . . . . 0 N--CA 1.466 0.359 0 CA-C-O 120.742 0.306 . . . . 0.0 110.579 -179.791 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 27.4 m . . . . . 0 N--CA 1.466 0.341 0 CA-C-O 120.899 0.38 . . . . 0.0 110.507 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 78.0 m-85 -97.58 131.18 44.41 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.229 -179.476 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 14.8 p -144.57 165.94 26.58 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.337 -179.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . 34.4 mt -65.51 146.01 55.39 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.485 -179.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 13.2 t80 -50.95 -48.46 60.93 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.337 -179.532 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 22.3 p30 -140.89 169.66 17.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.947 0.403 . . . . 0.0 110.441 -179.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -85.31 -17.28 37.31 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.384 -179.867 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 212' ' ' HIS . . . . . . . . . . . . . 85.3 m-70 -44.47 -65.49 0.51 Allowed 'General case' 0 C--O 1.237 0.412 0 CA-C-O 121.03 0.443 . . . . 0.0 110.569 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 11.4 p -48.28 -35.44 5.71 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.283 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 214' ' ' ALA . . . . . . . . . . . . . . . -64.79 -38.27 90.4 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.228 179.351 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 69.2 tp60 -62.21 -46.75 87.51 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 121.202 0.525 . . . . 0.0 110.021 -179.556 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 216' ' ' LEU . . . . . 0.537 ' CD1' ' N ' ' B' ' 216' ' ' LEU . 6.8 mp -61.7 -43.54 98.67 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 120.437 -0.505 . . . . 0.0 110.239 -179.409 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 95.7 mt -66.1 -36.2 82.53 Favored 'General case' 0 C--O 1.222 -0.347 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.286 179.17 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 89.0 m-20 -59.76 -43.01 94.5 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.094 -179.434 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 219' ' ' GLU . . . . . 0.507 ' O ' ' ND1' ' B' ' 223' ' ' HIS . 96.7 mt-10 -69.57 -52.53 25.38 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.413 179.231 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -56.5 -45.53 80.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.663 179.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 5.1 mm -63.27 -45.17 99.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.761 -179.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 91.0 t80 -63.91 -46.96 82.47 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.155 0.502 . . . . 0.0 110.676 179.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 223' ' ' HIS . . . . . 0.507 ' ND1' ' O ' ' B' ' 219' ' ' GLU . 46.2 m80 -60.36 -36.44 78.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.468 -179.623 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 224' ' ' SER . . . . . 0.415 ' OG ' ' OE1' ' A' ' 22' ' ' GLN . 10.2 t -76.36 -46.61 26.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.926 0.393 . . . . 0.0 110.836 179.643 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -55.44 -28.87 56.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.326 -179.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 55.6 t-80 . . . . . 0 C--N 1.332 -0.195 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.695 179.7 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 90.3 m-20 . . . . . 0 C--O 1.236 0.353 0 CA-C-O 121.123 0.487 . . . . 0.0 110.96 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 88.5 p -61.56 -37.51 84.08 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.347 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -66.17 -47.22 74.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.336 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.426 ' O ' ' CG2' ' A' ' 23' ' ' VAL . . . -56.24 -39.76 73.05 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.701 -0.4 . . . . 0.0 110.211 -179.753 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.04 -54.05 40.34 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.54 -0.464 . . . . 0.0 110.336 179.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -58.6 -47.93 82.68 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.29 -179.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -62.09 -50.97 69.81 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.984 -179.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.426 ' CG2' ' O ' ' A' ' 19' ' ' ALA . 95.1 t -61.25 -44.52 98.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.31 -179.699 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.1 -41.13 82.86 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.198 179.559 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 69.2 m -59.64 -43.64 93.79 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.137 179.616 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 85.7 m -62.91 -47.82 81.62 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.624 -0.43 . . . . 0.0 110.757 179.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 91.6 mt -67.82 -21.47 65.21 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.501 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 55.9 tt0 -75.33 -56.48 4.67 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.618 179.457 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.48 -53.9 52.78 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.614 -179.661 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.488 ' O ' ' O ' ' A' ' 31' ' ' ALA . 87.9 mt -47.13 -35.48 7.26 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 120.756 0.312 . . . . 0.0 110.196 -179.09 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.488 ' O ' ' O ' ' A' ' 30' ' ' LEU . . . -57.89 -140.35 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.44 179.103 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.432 ' O ' ' O ' ' A' ' 31' ' ' ALA . 47.2 m 57.65 112.75 0.02 OUTLIER Pre-proline 0 CA--C 1.54 0.574 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.98 -179.726 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . 0.419 ' O ' ' N ' ' A' ' 36' ' ' LEU . 51.3 Cg_exo -48.25 -59.07 1.38 Allowed 'Trans proline' 0 N--CA 1.495 1.617 0 C-N-CA 122.211 1.94 . . . . 0.0 113.306 -179.099 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.599 ' HG ' ' H ' ' A' ' 35' ' ' ARG . 81.1 p -44.74 -48.36 10.78 Favored 'General case' 0 C--O 1.237 0.445 0 CA-C-O 121.18 0.514 . . . . 0.0 111.014 -178.66 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.599 ' H ' ' HG ' ' A' ' 34' ' ' SER . 84.2 mtp180 -72.46 -24.61 61.22 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.344 179.764 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.419 ' N ' ' O ' ' A' ' 33' ' ' PRO . 0.2 OUTLIER -67.2 -55.41 14.22 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 119.901 -0.72 . . . . 0.0 111.337 -178.542 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 5.2 ptp -64.78 -43.76 92.18 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.255 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 97.5 mt -63.12 -45.31 98.96 Favored 'Isoleucine or valine' 0 C--O 1.241 0.63 0 CA-C-O 121.415 0.626 . . . . 0.0 110.477 -179.313 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 5.3 tt -63.21 -41.23 99.11 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.599 179.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 31.7 m -59.26 -43.07 92.46 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.077 179.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 17.3 mm100 -56.85 -45.32 82.49 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.545 -0.462 . . . . 0.0 110.019 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 31.7 mt -66.5 -40.08 89.05 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.509 -0.477 . . . . 0.0 110.979 179.006 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 73.8 ttp85 -60.24 -34.2 73.35 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.682 -179.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -57.15 -40.11 76.55 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.262 -179.559 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 167.45 170.54 32.4 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 111.052 -0.819 . . . . 0.0 111.052 179.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -65.6 144.08 77.39 Favored 'Trans proline' 0 C--N 1.307 -1.624 0 C-N-CA 122.779 2.319 . . . . 0.0 111.809 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 1.9 pp -175.09 146.65 0.96 Allowed Pre-proline 0 C--N 1.325 -0.47 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.869 179.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -72.17 167.39 26.95 Favored 'Trans proline' 0 N--CA 1.495 1.566 0 C-N-CA 122.821 2.347 . . . . 0.0 112.19 179.333 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.431 ' CG2' ' N ' ' A' ' 50' ' ' THR . 3.1 m -62.38 -38.41 81.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 121.494 0.664 . . . . 0.0 110.425 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.431 ' N ' ' CG2' ' A' ' 49' ' ' VAL . 73.9 m -58.67 -44.65 90.24 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 114.526 -1.216 . . . . 0.0 110.293 179.781 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.422 ' O ' ' OD1' ' A' ' 51' ' ' ASP . 64.8 t0 -68.21 -37.2 80.63 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.923 -0.581 . . . . 0.0 109.907 178.579 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.43 ' C ' ' CD1' ' A' ' 52' ' ' LEU . 3.1 tm? -62.83 -44.34 96.41 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 119.988 -0.685 . . . . 0.0 110.25 -179.561 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.02 -43.32 99.07 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.587 179.834 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -60.19 -49.11 78.91 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 120.332 -0.547 . . . . 0.0 110.527 179.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.72 -52.35 57.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.035 -179.509 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.44 ' CG2' ' O ' ' A' ' 56' ' ' ILE . 7.6 tt -176.02 87.76 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.458 -0.073 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.941 -179.461 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -164.92 -57.17 0.02 OUTLIER Glycine 0 CA--C 1.52 0.389 0 N-CA-C 110.353 -1.099 . . . . 0.0 110.353 178.137 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 66.5 mtt 53.73 27.54 7.07 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.285 179.639 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.421 ' HG2' ' H ' ' A' ' 62' ' ' ALA . 70.6 tt0 -165.72 89.35 0.43 Allowed 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -74.1 -21.91 59.7 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.84 -179.328 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 78.1 p -67.15 -41.74 85.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.792 -179.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.421 ' H ' ' HG2' ' A' ' 59' ' ' GLU . . . -67.14 -32.12 73.03 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.473 179.78 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 83.6 t -69.99 -51.79 36.7 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.24 0 CA-C-N 116.488 -0.323 . . . . 0.0 110.778 179.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 99.3 p -60.33 -38.59 84.23 Favored 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 120.766 -0.374 . . . . 0.0 110.448 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 56.7 t-80 -66.39 -49.94 65.14 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-O 121.036 0.446 . . . . 0.0 110.703 -179.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 91.2 mm-40 -63.65 -38.01 89.51 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.242 179.658 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.5 tp -61.82 -45.27 94.54 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.002 -0.544 . . . . 0.0 109.776 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 60.9 ttt85 -60.63 -45.16 95.09 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.499 -0.48 . . . . 0.0 110.483 -179.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 85.5 t -62.74 -54.65 31.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 C-N-CA 120.093 -0.643 . . . . 0.0 110.145 -179.457 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 78.4 mt -58.64 -35.15 72.07 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.08 0.467 . . . . 0.0 110.057 -179.196 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 70.0 ttt180 -60.43 -40.54 91.41 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.304 179.515 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 40.9 t-20 -62.36 -44.03 97.43 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 120.45 -0.5 . . . . 0.0 110.483 -179.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 6.4 mt -67.88 -39.9 83.61 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.347 -179.212 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 104.66 29.0 5.48 Favored Glycine 0 CA--C 1.526 0.779 0 N-CA-C 110.808 -0.917 . . . . 0.0 110.808 -179.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 92.5 mt -90.28 -19.35 24.2 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.869 0.366 . . . . 0.0 110.838 179.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 21.8 m -135.82 158.25 39.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.097 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.416 ' CG1' ' N ' ' A' ' 78' ' ' GLY . 39.3 t -141.59 155.88 20.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.508 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . 0.416 ' N ' ' CG1' ' A' ' 77' ' ' VAL . . . -117.68 142.19 17.01 Favored Glycine 0 CA--C 1.524 0.649 0 N-CA-C 110.185 -1.166 . . . . 0.0 110.185 178.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 . . . . . 0 N--CA 1.466 0.326 0 CA-C-O 120.745 0.307 . . . . 0.0 110.311 179.896 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.8 m . . . . . 0 N--CA 1.467 0.393 0 CA-C-O 120.837 0.351 . . . . 0.0 110.589 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 63.1 m-85 -106.81 133.64 51.16 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.061 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 74.5 m -151.23 171.71 16.98 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 64.0 mt -63.99 150.56 44.97 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.584 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -52.73 -48.65 66.52 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.398 -179.5 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 90.3 m-20 -139.71 166.92 23.32 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.078 0.466 . . . . 0.0 110.572 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 47.9 p -76.11 -24.22 54.96 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.835 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . 0.573 ' CB ' ' CE1' ' B' ' 223' ' ' HIS . 68.2 m80 -41.15 -60.12 1.32 Allowed 'General case' 0 C--O 1.237 0.416 0 CA-C-O 121.186 0.517 . . . . 0.0 110.72 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 10.8 m -55.81 -40.1 59.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.925 -0.58 . . . . 0.0 109.957 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -56.77 -41.15 77.1 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.987 0.422 . . . . 0.0 110.508 179.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.458 ' O ' ' OE1' ' A' ' 100' ' ' GLU . 6.1 tp-100 -64.76 -42.51 95.09 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.137 179.777 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 17.2 tp -59.6 -45.63 91.33 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.188 -0.605 . . . . 0.0 110.341 -178.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -65.51 -36.26 83.31 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.103 179.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 66.9 t0 -58.77 -43.17 90.33 Favored 'General case' 0 C--N 1.32 -0.706 0 C-N-CA 120.415 -0.514 . . . . 0.0 110.434 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.478 ' N ' ' OE1' ' A' ' 100' ' ' GLU . 2.7 mp0 -69.02 -50.41 49.04 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.484 179.786 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.35 -44.67 92.64 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.759 -0.376 . . . . 0.0 110.38 -179.685 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 4.8 mm -62.76 -45.04 99.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 C-N-CA 120.666 -0.414 . . . . 0.0 110.42 -179.264 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 73.2 t80 -64.09 -44.45 92.29 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.057 0.456 . . . . 0.0 110.389 179.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' HIS . . . . . 0.551 ' CE1' ' CB ' ' B' ' 212' ' ' HIS . 25.7 t60 -59.14 -39.17 81.52 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.74 179.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 12.3 t -77.04 -44.57 30.28 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.918 0.39 . . . . 0.0 111.25 179.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 79.5 tt0 -55.82 -31.1 62.39 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.472 -179.173 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.328 -0.329 0 C-N-CA 120.388 -0.525 . . . . 0.0 110.195 -179.214 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 . . . . . 0 C--O 1.236 0.359 0 CA-C-O 121.117 0.484 . . . . 0.0 110.81 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 78.3 p -62.38 -37.0 84.06 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.328 179.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -66.2 -47.28 74.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.267 179.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 138' ' ' ALA . . . . . 0.423 ' O ' ' CG2' ' B' ' 142' ' ' VAL . . . -56.33 -39.61 73.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.076 -179.77 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -64.23 -54.09 38.86 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.512 -0.475 . . . . 0.0 110.392 179.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -58.75 -48.03 82.61 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.326 -179.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -61.93 -51.21 69.06 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.22 0.533 . . . . 0.0 111.006 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 142' ' ' VAL . . . . . 0.423 ' CG2' ' O ' ' B' ' 138' ' ' ALA . 96.1 t -61.02 -44.3 97.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.214 -179.699 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -57.5 -41.53 80.95 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 110.062 -0.347 . . . . 0.0 110.062 179.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 68.0 m -59.54 -44.08 93.32 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.199 179.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 71.4 m -62.8 -48.51 78.81 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 120.99 0.424 . . . . 0.0 110.962 179.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 92.7 mt -67.38 -21.59 65.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.528 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 147' ' ' GLN . . . . . . . . . . . . . 56.2 tt0 -75.3 -56.24 4.92 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.634 179.367 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -58.94 -53.96 52.47 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.687 -179.552 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.477 ' O ' ' O ' ' B' ' 150' ' ' ALA . 91.2 mt -47.37 -34.92 7.52 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-O 120.846 0.355 . . . . 0.0 110.179 -179.177 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 150' ' ' ALA . . . . . 0.477 ' O ' ' O ' ' B' ' 149' ' ' LEU . . . -58.74 -140.68 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.54 179.177 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 151' ' ' THR . . . . . 0.428 ' O ' ' O ' ' B' ' 150' ' ' ALA . 29.3 m 57.16 112.04 0.02 OUTLIER Pre-proline 0 CA--C 1.54 0.572 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.951 -179.517 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 152' ' ' PRO . . . . . 0.405 ' O ' ' N ' ' B' ' 155' ' ' LEU . 51.8 Cg_exo -47.47 -58.39 1.76 Allowed 'Trans proline' 0 N--CA 1.5 1.866 0 C-N-CA 122.396 2.064 . . . . 0.0 113.376 -179.068 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 153' ' ' SER . . . . . 0.6 ' HG ' ' H ' ' B' ' 154' ' ' ARG . 88.6 p -45.18 -47.67 12.44 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 121.33 0.585 . . . . 0.0 110.858 -178.761 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 154' ' ' ARG . . . . . 0.6 ' H ' ' HG ' ' B' ' 153' ' ' SER . 83.6 mtp180 -73.52 -25.21 60.32 Favored 'General case' 0 C--N 1.319 -0.729 0 C-N-CA 120.338 -0.545 . . . . 0.0 110.291 179.802 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 155' ' ' LEU . . . . . 0.405 ' N ' ' O ' ' B' ' 152' ' ' PRO . 0.2 OUTLIER -66.42 -55.98 13.18 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 119.855 -0.738 . . . . 0.0 111.283 -178.337 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.66 -45.28 90.86 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.585 179.5 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 97.0 mt -62.59 -45.23 99.32 Favored 'Isoleucine or valine' 0 C--O 1.241 0.653 0 CA-C-O 121.496 0.665 . . . . 0.0 110.406 -179.207 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 5.8 tt -63.21 -41.24 99.12 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.685 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 83.3 m -59.14 -42.84 91.6 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.843 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 17.5 mm100 -57.0 -45.24 83.16 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.966 179.516 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 161' ' ' LEU . . . . . . . . . . . . . 33.2 mt -66.26 -40.68 90.32 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.415 -0.514 . . . . 0.0 111.104 178.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 162' ' ' ARG . . . . . . . . . . . . . 73.7 ttp85 -60.24 -33.07 71.77 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.704 -179.71 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 17.5 t-20 -58.45 -40.52 82.83 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.383 -179.501 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . 168.58 168.92 31.35 Favored Glycine 0 CA--C 1.525 0.673 0 N-CA-C 110.984 -0.846 . . . . 0.0 110.984 179.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -65.83 144.42 77.22 Favored 'Trans proline' 0 C--N 1.308 -1.58 0 C-N-CA 122.836 2.357 . . . . 0.0 111.824 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 2.0 pp -176.23 147.39 0.83 Allowed Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.888 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -72.79 169.14 22.75 Favored 'Trans proline' 0 N--CA 1.496 1.674 0 C-N-CA 122.631 2.221 . . . . 0.0 112.129 179.058 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 168' ' ' VAL . . . . . 0.413 ' CG2' ' N ' ' B' ' 169' ' ' THR . 3.8 m -63.28 -38.27 81.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 121.446 0.641 . . . . 0.0 110.514 -179.69 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 169' ' ' THR . . . . . 0.413 ' N ' ' CG2' ' B' ' 168' ' ' VAL . 71.5 m -58.5 -44.81 89.56 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 114.597 -1.183 . . . . 0.0 110.35 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 53.6 t0 -69.03 -36.46 77.78 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.822 178.661 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 171' ' ' LEU . . . . . 0.424 ' C ' ' CD1' ' B' ' 171' ' ' LEU . 3.1 tm? -63.42 -44.17 95.39 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.001 -0.68 . . . . 0.0 110.308 -179.669 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 172' ' ' ALA . . . . . . . . . . . . . . . -61.0 -43.43 98.9 Favored 'General case' 0 CA--C 1.512 -0.494 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.541 179.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -59.93 -48.19 82.72 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 120.284 -0.566 . . . . 0.0 110.403 179.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -65.04 -52.77 53.99 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.026 -179.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 175' ' ' ILE . . . . . 0.41 ' O ' ' CG2' ' B' ' 175' ' ' ILE . 7.7 tt -176.17 87.42 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.456 -0.131 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.963 -179.425 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . -164.38 -57.41 0.02 OUTLIER Glycine 0 CA--C 1.522 0.491 0 N-CA-C 110.528 -1.029 . . . . 0.0 110.528 178.25 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 65.3 mtt 53.69 27.47 6.91 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.88 -0.328 . . . . 0.0 110.438 179.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 178' ' ' GLU . . . . . 0.431 ' HG2' ' H ' ' B' ' 181' ' ' ALA . 73.8 tt0 -164.62 87.73 0.47 Allowed 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 11.5 mt-30 -73.48 -23.09 60.02 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.822 -179.312 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 78.2 p -66.92 -41.2 87.47 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.86 -179.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 181' ' ' ALA . . . . . 0.431 ' H ' ' HG2' ' B' ' 178' ' ' GLU . . . -66.96 -33.29 75.24 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.27 179.739 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 77.9 t -69.69 -51.27 42.64 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.197 0 C-N-CA 120.721 -0.392 . . . . 0.0 110.781 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 92.1 p -59.28 -41.65 89.42 Favored 'General case' 0 C--N 1.332 -0.154 0 C-N-CA 120.675 -0.41 . . . . 0.0 110.566 -179.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 63.5 t-80 -66.26 -48.49 70.32 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-O 121.114 0.483 . . . . 0.0 110.757 -179.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 2.9 tp-100 -63.81 -37.43 87.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.107 -179.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 9.8 tp -63.22 -44.26 95.78 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.917 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 61.6 ttt85 -59.76 -44.34 93.91 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.614 -0.434 . . . . 0.0 110.23 -179.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 90.1 t -63.38 -54.28 34.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 C-N-CA 120.021 -0.672 . . . . 0.0 110.215 -179.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 85.6 mt -58.96 -36.09 74.23 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.161 0.505 . . . . 0.0 109.989 -179.111 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 70.1 ttt180 -60.21 -41.91 94.05 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.205 179.412 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 39.2 t-20 -60.37 -47.23 86.94 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 120.431 -0.508 . . . . 0.0 110.388 -179.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 192' ' ' LEU . . . . . . . . . . . . . 9.7 mt -65.06 -39.58 93.47 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.918 0.39 . . . . 0.0 110.565 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 193' ' ' GLY . . . . . 0.4 ' O ' ' CD2' ' B' ' 209' ' ' TYR . . . 104.41 28.77 5.63 Favored Glycine 0 CA--C 1.525 0.715 0 N-CA-C 110.855 -0.898 . . . . 0.0 110.855 -179.768 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 92.8 mt -88.86 -19.65 25.62 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.911 0.386 . . . . 0.0 110.758 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 24.6 m -136.05 158.94 39.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.157 -0.474 . . . . 0.0 109.99 179.705 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 196' ' ' VAL . . . . . 0.414 ' CG1' ' N ' ' B' ' 197' ' ' GLY . 41.3 t -141.71 156.29 20.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.442 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 197' ' ' GLY . . . . . 0.414 ' N ' ' CG1' ' B' ' 196' ' ' VAL . . . -117.6 142.23 17.07 Favored Glycine 0 CA--C 1.525 0.703 0 N-CA-C 110.202 -1.159 . . . . 0.0 110.202 179.151 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 . . . . . 0 C--O 1.237 0.399 0 CA-C-O 120.664 0.269 . . . . 0.0 110.364 179.829 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 26.8 m . . . . . 0 N--CA 1.466 0.373 0 CA-C-O 120.783 0.325 . . . . 0.0 110.548 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 65.7 m-85 -106.96 133.74 51.15 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.118 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 58.2 m -151.38 171.79 16.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.274 -179.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . 68.9 mt -64.53 150.2 47.19 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.487 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 209' ' ' TYR . . . . . 0.4 ' CD2' ' O ' ' B' ' 193' ' ' GLY . 5.9 t80 -52.59 -47.44 66.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.394 -179.59 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 89.0 m-20 -140.19 167.4 22.22 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 121.165 0.507 . . . . 0.0 110.603 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 40.9 p -78.17 -23.88 47.48 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.668 179.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 212' ' ' HIS . . . . . 0.551 ' CB ' ' CE1' ' A' ' 104' ' ' HIS . 65.1 m80 -41.4 -59.46 1.56 Allowed 'General case' 0 C--O 1.236 0.373 0 CA-C-O 121.25 0.547 . . . . 0.0 110.552 -179.892 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 8.7 m -55.87 -41.07 65.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.815 -0.63 . . . . 0.0 109.884 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 214' ' ' ALA . . . . . . . . . . . . . . . -55.52 -40.91 72.4 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.471 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 215' ' ' GLN . . . . . 0.439 ' O ' ' OE1' ' B' ' 219' ' ' GLU . 7.1 tp-100 -65.23 -42.78 93.04 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.217 179.733 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 216' ' ' LEU . . . . . . . . . . . . . 12.6 tp -59.25 -46.0 89.67 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.166 -0.614 . . . . 0.0 110.387 -178.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -64.98 -37.09 86.49 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.983 179.282 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 43.6 t0 -58.12 -42.42 85.72 Favored 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 120.496 -0.482 . . . . 0.0 110.49 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 219' ' ' GLU . . . . . 0.494 ' OE1' ' N ' ' B' ' 219' ' ' GLU . 2.4 mp0 -69.34 -51.67 34.74 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.505 179.732 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -58.33 -44.67 88.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.346 -179.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 4.8 mm -62.67 -44.9 99.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.601 -179.265 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 74.5 t80 -64.55 -43.71 93.11 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.069 0.462 . . . . 0.0 110.299 179.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 223' ' ' HIS . . . . . 0.573 ' CE1' ' CB ' ' A' ' 93' ' ' HIS . 32.4 t60 -59.65 -38.96 82.85 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.693 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 9.7 t -77.1 -44.94 28.68 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.991 0.424 . . . . 0.0 111.295 179.593 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -55.93 -31.16 62.67 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.438 -179.229 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 1.2 t60 . . . . . 0 C--N 1.328 -0.331 0 C-N-CA 120.373 -0.531 . . . . 0.0 110.118 -179.326 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 . . . . . 0 C--O 1.234 0.284 0 CA-C-O 121.117 0.485 . . . . 0.0 111.169 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 58.5 m -53.86 -34.48 59.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.455 -179.22 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -68.03 -49.57 60.66 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.649 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -54.74 -35.85 64.17 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.32 -52.66 37.66 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.423 179.26 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.99 -49.2 77.63 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.797 0.332 . . . . 0.0 111.0 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 86.5 mt-30 -56.06 -50.95 69.54 Favored 'General case' 0 C--O 1.242 0.673 0 CA-C-O 121.279 0.561 . . . . 0.0 110.666 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 90.6 t -60.49 -45.09 97.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.784 179.688 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -49.17 -46.17 45.04 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 121.014 -0.274 . . . . 0.0 110.391 179.216 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 36.0 t -59.56 -43.95 93.41 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.101 -0.499 . . . . 0.0 109.85 -179.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 20.2 m -65.68 -51.27 60.78 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.18 0.514 . . . . 0.0 110.812 179.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.415 ' O ' ' O ' ' B' ' 146' ' ' LEU . 4.1 mm? -62.26 -25.58 67.91 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.771 -179.896 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 54.7 tt0 -75.14 -53.38 8.95 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.849 179.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.47 -56.6 19.91 Favored 'General case' 0 CA--C 1.521 -0.171 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.838 -179.232 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.498 ' O ' ' O ' ' A' ' 31' ' ' ALA . 8.0 mp -45.11 -34.91 2.83 Favored 'General case' 0 CA--C 1.516 -0.364 0 C-N-CA 120.958 -0.297 . . . . 0.0 110.214 -179.237 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.498 ' O ' ' O ' ' A' ' 30' ' ' LEU . . . -57.31 -140.48 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.17 0.51 . . . . 0.0 110.357 179.291 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 37.7 m 59.66 110.1 0.02 OUTLIER Pre-proline 0 C--N 1.325 -0.487 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.308 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -51.15 -52.57 8.8 Favored 'Trans proline' 0 N--CA 1.496 1.641 0 C-N-CA 122.372 2.048 . . . . 0.0 113.155 -179.022 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 64.7 m -55.7 -45.48 77.85 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.902 -178.585 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 36.8 ttm180 -61.97 -44.44 96.75 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.733 -179.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 8.3 mt -62.08 -48.45 80.16 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.809 -0.356 . . . . 0.0 110.866 -179.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.468 ' O ' ' OG1' ' A' ' 40' ' ' THR . 49.8 ttp -53.95 -48.84 69.86 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-O 121.233 0.539 . . . . 0.0 110.204 179.612 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 97.9 mt -64.59 -42.72 95.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 121.342 0.591 . . . . 0.0 110.315 179.451 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 12.0 tp -62.24 -42.77 99.62 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.683 -179.273 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.468 ' OG1' ' O ' ' A' ' 37' ' ' MET . 21.3 p -59.52 -38.78 81.88 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.2 -0.455 . . . . 0.0 109.847 179.799 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -60.96 -46.47 90.6 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.536 -0.466 . . . . 0.0 110.005 178.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 92.8 mt -63.57 -38.78 92.45 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.755 179.268 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.42 ' O ' ' ND2' ' A' ' 44' ' ' ASN . 72.5 ttp85 -50.81 -42.82 58.6 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.418 -179.416 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.42 ' ND2' ' O ' ' A' ' 43' ' ' ARG . 12.8 m120 -135.36 48.81 2.22 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.375 179.582 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -175.23 78.77 0.08 OUTLIER Glycine 0 CA--C 1.529 0.959 0 N-CA-C 111.046 -0.822 . . . . 0.0 111.046 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -79.41 112.38 2.98 Favored 'Trans proline' 0 C--N 1.31 -1.461 0 C-N-CA 122.745 2.297 . . . . 0.0 111.504 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -160.75 156.01 21.16 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.622 -178.936 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -66.04 -178.66 1.12 Allowed 'Trans proline' 0 C--N 1.309 -1.527 0 C-N-CA 122.696 2.264 . . . . 0.0 111.89 179.034 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.523 ' CG2' ' N ' ' A' ' 50' ' ' THR . 3.5 m -68.06 -45.7 82.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 121.559 0.695 . . . . 0.0 111.383 -179.836 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.523 ' N ' ' CG2' ' A' ' 49' ' ' VAL . 58.3 p -55.85 -41.22 74.01 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.364 -0.834 . . . . 0.0 110.454 -179.516 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 66.9 m-20 -74.55 -40.24 61.82 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.507 179.457 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.7 tt -60.98 -38.43 85.95 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.825 -179.658 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.585 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -69.63 -45.37 68.65 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.146 179.442 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 81.8 tt0 -52.76 -43.42 65.77 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.767 -0.373 . . . . 0.0 110.089 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -62.33 -42.95 99.8 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.538 179.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 96.6 mt -84.44 -67.12 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.454 179.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . 0.585 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 143.73 70.93 0.02 OUTLIER Glycine 0 CA--C 1.523 0.574 0 N-CA-C 111.141 -0.784 . . . . 0.0 111.141 179.672 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.426 ' C ' ' SD ' ' A' ' 58' ' ' MET . 2.7 tmm? 68.31 97.53 0.06 Allowed 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.76 -0.376 . . . . 0.0 110.762 179.647 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -173.85 24.9 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.078 0.466 . . . . 0.0 110.41 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -70.75 -23.58 62.45 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.044 0.45 . . . . 0.0 110.359 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 9.6 t -66.27 -44.37 83.8 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.584 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.1 -33.22 71.81 Favored 'General case' 0 C--O 1.24 0.605 0 CA-C-N 115.936 -0.575 . . . . 0.0 109.978 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 80.6 t -66.94 -49.99 68.79 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.083 179.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 50.5 m -53.04 -42.55 65.86 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 120.985 0.421 . . . . 0.0 110.163 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 83.4 t60 -58.3 -41.26 84.05 Favored 'General case' 0 C--O 1.242 0.697 0 CA-C-O 121.38 0.61 . . . . 0.0 109.63 178.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 55.1 tt0 -60.45 -38.86 85.51 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.859 -0.61 . . . . 0.0 109.993 179.249 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 24.0 mt -62.19 -42.35 99.2 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.391 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -55.26 -47.19 75.83 Favored 'General case' 0 C--O 1.24 0.575 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.874 179.481 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 90.7 t -68.31 -48.76 71.74 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.153 0 CA-C-O 121.172 0.51 . . . . 0.0 110.403 178.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.658 ' O ' ' N ' ' A' ' 74' ' ' GLY . 0.1 OUTLIER -49.06 -45.54 43.15 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 -179.277 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.612 ' N ' ' HG ' ' A' ' 70' ' ' LEU . 90.5 mtt-85 -62.35 -43.76 98.07 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.791 -178.508 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 99.2 m-20 -65.34 -41.22 94.13 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.598 179.226 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.495 ' CD2' ' N ' ' A' ' 73' ' ' LEU . 4.0 mm? -95.61 -64.32 1.07 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.264 -179.135 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . 0.658 ' N ' ' O ' ' A' ' 70' ' ' LEU . . . 105.97 83.57 1.65 Allowed Glycine 0 CA--C 1.519 0.33 0 N-CA-C 110.54 -1.024 . . . . 0.0 110.54 -179.249 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 14.7 tp -125.64 -14.63 6.24 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.953 0.406 . . . . 0.0 110.549 -179.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.446 ' HA ' ' N ' ' A' ' 90' ' ' TYR . 3.3 m -142.71 172.53 8.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.399 -179.763 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 24.6 t -137.62 150.93 25.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.577 178.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -128.58 146.92 17.26 Favored Glycine 0 CA--C 1.523 0.578 0 N-CA-C 110.446 -1.062 . . . . 0.0 110.446 179.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 . . . . . 0 N--CA 1.466 0.351 0 CA-C-O 120.774 0.321 . . . . 0.0 110.435 -179.852 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 64.8 t . . . . . 0 C--O 1.227 -0.128 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 94.3 m-85 -100.23 130.88 46.41 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.672 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 35.2 p -150.56 169.85 20.53 Favored 'General case' 0 C--O 1.223 -0.301 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 179.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.731 ' CD2' ' H ' ' A' ' 89' ' ' LEU . 0.6 OUTLIER -63.74 150.87 43.54 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.661 -179.626 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.446 ' N ' ' HA ' ' A' ' 76' ' ' VAL . 28.4 t80 -51.4 -48.9 62.47 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.244 -178.576 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.531 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 16.0 p-10 -153.05 -178.78 7.15 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.735 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 2.2 m -73.65 -3.26 27.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.422 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 8.5 t-160 -54.01 -74.85 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.062 0.458 . . . . 0.0 110.531 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 11.6 p -57.49 -33.81 45.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.324 -179.521 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.06 -47.67 84.9 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.633 179.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.44 ' O ' ' OE2' ' A' ' 100' ' ' GLU . 59.7 tt0 -63.87 -46.52 84.59 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.393 -179.749 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 13.8 tp -56.74 -45.7 81.83 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.221 -179.325 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 85.7 mt -63.32 -41.0 98.87 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.38 179.204 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -52.16 -45.04 64.91 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.41 -179.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.44 ' OE2' ' O ' ' A' ' 96' ' ' GLN . 0.9 OUTLIER -69.74 -50.46 43.27 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.666 -0.413 . . . . 0.0 110.903 179.782 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -57.92 -53.55 56.91 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.923 -178.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . 0.439 ' N ' ' CD1' ' A' ' 102' ' ' ILE . 1.2 mp -61.74 -44.93 99.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.617 -179.688 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 78.3 t80 -61.23 -50.61 72.39 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 120.492 -0.483 . . . . 0.0 110.804 -179.024 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' HIS . . . . . 0.41 ' CB ' ' CD2' ' B' ' 212' ' ' HIS . 68.7 m-70 -63.29 -36.96 85.4 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.615 -179.654 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 6.2 t -72.07 -46.14 58.04 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.93 179.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 81.7 tt0 -60.4 -24.43 65.14 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.187 -179.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 12.2 t-80 . . . . . 0 C--N 1.33 -0.246 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.645 179.588 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 . . . . . 0 C--O 1.236 0.365 0 CA-C-O 121.194 0.521 . . . . 0.0 111.179 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 42.0 m -52.34 -35.76 51.74 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.435 -179.324 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 10.7 tt0 -66.86 -48.93 67.3 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.625 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 138' ' ' ALA . . . . . . . . . . . . . . . -55.35 -35.57 65.36 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -67.19 -52.83 36.5 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.946 0.403 . . . . 0.0 110.433 179.33 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -58.13 -48.99 78.53 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.749 179.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 87.1 mt-30 -56.4 -51.09 69.63 Favored 'General case' 0 C--O 1.241 0.608 0 CA-C-O 121.303 0.573 . . . . 0.0 110.779 -179.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 142' ' ' VAL . . . . . . . . . . . . . 93.5 t -60.47 -45.0 97.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.688 179.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -49.84 -46.02 50.91 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.467 179.536 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 14.9 t -58.84 -45.89 88.99 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.207 -0.451 . . . . 0.0 109.933 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 22.9 m -64.61 -51.22 63.8 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 121.121 0.486 . . . . 0.0 110.915 179.244 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 146' ' ' LEU . . . . . 0.415 ' O ' ' O ' ' A' ' 27' ' ' LEU . 4.1 mm? -61.63 -26.7 68.16 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.718 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 147' ' ' GLN . . . . . . . . . . . . . 55.3 tt0 -75.01 -54.31 7.4 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.847 179.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -58.06 -55.9 28.92 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.754 -179.203 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.518 ' O ' ' O ' ' B' ' 150' ' ' ALA . 8.6 mp -45.55 -35.17 3.74 Favored 'General case' 0 CA--C 1.513 -0.479 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.264 -179.228 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 150' ' ' ALA . . . . . 0.518 ' O ' ' O ' ' B' ' 149' ' ' LEU . . . -56.79 -140.7 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.114 0.483 . . . . 0.0 110.434 179.32 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 151' ' ' THR . . . . . . . . . . . . . 84.5 m 59.54 109.38 0.03 OUTLIER Pre-proline 0 C--N 1.324 -0.536 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.336 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -50.46 -54.54 5.28 Favored 'Trans proline' 0 N--CA 1.497 1.689 0 C-N-CA 122.407 2.071 . . . . 0.0 113.066 -179.238 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 52.4 m -53.21 -45.7 68.74 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.953 -178.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 37.7 ttm180 -62.54 -44.28 96.74 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.749 -179.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 155' ' ' LEU . . . . . . . . . . . . . 8.6 mt -62.37 -46.72 87.38 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.831 -0.347 . . . . 0.0 110.918 -179.604 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 156' ' ' MET . . . . . 0.484 ' O ' ' OG1' ' B' ' 159' ' ' THR . 46.6 ttp -55.45 -49.07 73.43 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.298 0.571 . . . . 0.0 110.206 179.623 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 97.0 mt -64.62 -42.84 96.23 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 0 CA-C-O 121.276 0.56 . . . . 0.0 110.258 179.404 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 7.6 tp -62.1 -41.61 98.39 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.7 -179.257 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 159' ' ' THR . . . . . 0.484 ' OG1' ' O ' ' B' ' 156' ' ' MET . 16.9 p -60.67 -38.13 83.88 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.459 . . . . 0.0 109.956 179.85 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 87.1 mt-30 -61.75 -46.27 90.33 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.067 178.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 161' ' ' LEU . . . . . . . . . . . . . 90.4 mt -63.59 -38.72 92.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.713 179.267 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 162' ' ' ARG . . . . . 0.471 ' O ' ' ND2' ' B' ' 163' ' ' ASN . 73.7 ttp85 -50.23 -41.0 49.22 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.505 -179.425 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 163' ' ' ASN . . . . . 0.471 ' ND2' ' O ' ' B' ' 162' ' ' ARG . 16.0 m120 -138.4 49.83 1.9 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.376 179.736 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . -175.87 76.89 0.08 OUTLIER Glycine 0 CA--C 1.528 0.887 0 N-CA-C 111.119 -0.792 . . . . 0.0 111.119 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -77.43 114.34 3.71 Favored 'Trans proline' 0 N--CA 1.494 1.535 0 C-N-CA 122.8 2.333 . . . . 0.0 111.593 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -160.36 157.37 24.32 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.656 -178.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -65.17 176.69 2.99 Favored 'Trans proline' 0 C--N 1.308 -1.595 0 C-N-CA 122.817 2.345 . . . . 0.0 111.753 179.006 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 168' ' ' VAL . . . . . 0.486 ' CG2' ' N ' ' B' ' 169' ' ' THR . 3.8 m -63.22 -43.47 98.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 121.522 0.677 . . . . 0.0 111.306 -179.718 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 169' ' ' THR . . . . . 0.486 ' N ' ' CG2' ' B' ' 168' ' ' VAL . 52.3 p -57.21 -66.65 0.42 Allowed 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.639 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 92.9 m-20 -50.02 -38.69 38.7 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 -179.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 5.0 tt -59.43 -41.91 90.64 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.59 -0.444 . . . . 0.0 109.999 179.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 172' ' ' ALA . . . . . 0.598 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -67.66 -43.19 80.84 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.55 -0.296 . . . . 0.0 110.306 179.386 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 85.3 tt0 -53.33 -42.36 66.65 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.054 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -62.83 -40.87 98.76 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.4 179.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 96.5 mt -87.87 -68.31 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.314 179.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 176' ' ' GLY . . . . . 0.598 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 144.75 72.75 0.02 OUTLIER Glycine 0 CA--C 1.524 0.62 0 N-CA-C 111.078 -0.809 . . . . 0.0 111.078 179.531 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 3.1 tmm? 67.26 97.95 0.05 Allowed 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.673 -0.411 . . . . 0.0 110.591 179.593 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -173.07 22.46 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.204 0.526 . . . . 0.0 110.431 179.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -69.15 -24.75 64.12 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.037 0.446 . . . . 0.0 110.384 -179.876 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 12.1 t -65.71 -43.65 88.47 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 121.182 0.515 . . . . 0.0 110.503 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -60.85 -32.41 71.82 Favored 'General case' 0 C--O 1.239 0.53 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.089 179.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 94.5 t -67.21 -50.56 62.05 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.375 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.102 179.544 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 70.0 m -53.02 -41.94 65.18 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 121.029 0.442 . . . . 0.0 110.129 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -58.59 -42.22 87.58 Favored 'General case' 0 C--O 1.242 0.676 0 CA-C-O 121.406 0.622 . . . . 0.0 109.788 178.634 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 58.4 tt0 -60.09 -38.67 83.63 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.087 179.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 22.1 mt -62.24 -42.71 99.56 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-O 120.922 0.392 . . . . 0.0 110.52 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -54.95 -47.19 74.82 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.681 179.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 97.0 t -67.79 -48.85 74.11 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.106 0 C-N-CA 120.427 -0.509 . . . . 0.0 110.255 178.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 189' ' ' LEU . . . . . 0.686 ' O ' ' N ' ' B' ' 193' ' ' GLY . 0.1 OUTLIER -49.58 -45.4 47.76 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 -179.146 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 190' ' ' ARG . . . . . 0.614 ' N ' ' HG ' ' B' ' 189' ' ' LEU . 90.3 mtt-85 -61.81 -43.21 99.31 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.727 -0.67 . . . . 0.0 109.716 -178.485 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -66.07 -41.07 91.26 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.937 179.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 192' ' ' LEU . . . . . 0.507 ' CD2' ' N ' ' B' ' 192' ' ' LEU . 4.0 mm? -95.8 -61.63 1.42 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.306 -178.862 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 193' ' ' GLY . . . . . 0.686 ' N ' ' O ' ' B' ' 189' ' ' LEU . . . 103.05 82.47 1.63 Allowed Glycine 0 CA--C 1.52 0.349 0 N-CA-C 110.462 -1.055 . . . . 0.0 110.462 -179.42 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 15.6 tp -124.68 -15.0 6.66 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-O 120.951 0.405 . . . . 0.0 110.743 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 195' ' ' VAL . . . . . 0.459 ' HA ' ' N ' ' B' ' 209' ' ' TYR . 3.0 m -142.2 171.91 9.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.376 -179.724 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 196' ' ' VAL . . . . . . . . . . . . . 24.7 t -137.76 152.17 26.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.473 178.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 197' ' ' GLY . . . . . . . . . . . . . . . -130.68 148.36 18.7 Favored Glycine 0 CA--C 1.522 0.494 0 N-CA-C 110.54 -1.024 . . . . 0.0 110.54 179.23 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 89.1 m-20 . . . . . 0 C--O 1.236 0.355 0 CA-C-O 120.803 0.335 . . . . 0.0 110.621 -179.784 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 71.2 t . . . . . 0 C--O 1.226 -0.154 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -101.27 130.76 47.46 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.675 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 18.0 p -151.13 170.3 19.77 Favored 'General case' 0 C--O 1.223 -0.339 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 208' ' ' LEU . . . . . 0.742 ' CD2' ' H ' ' B' ' 208' ' ' LEU . 0.5 OUTLIER -63.41 152.07 39.23 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.653 -179.583 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 209' ' ' TYR . . . . . 0.459 ' N ' ' HA ' ' B' ' 195' ' ' VAL . 29.0 t80 -53.96 -48.38 70.37 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.234 -178.578 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 210' ' ' ASP . . . . . 0.531 ' N ' ' OD1' ' B' ' 210' ' ' ASP . 16.3 p-10 -151.56 179.8 8.06 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.74 179.806 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 2.5 m -74.19 -1.81 22.01 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.473 -179.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 212' ' ' HIS . . . . . 0.41 ' CD2' ' CB ' ' A' ' 104' ' ' HIS . 9.0 t-160 -56.04 -73.63 0.06 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.992 0.425 . . . . 0.0 110.46 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 9.6 p -57.54 -33.02 43.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.319 -179.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 214' ' ' ALA . . . . . . . . . . . . . . . -61.34 -47.96 83.52 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.637 179.699 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 215' ' ' GLN . . . . . 0.443 ' O ' ' OE1' ' B' ' 219' ' ' GLU . 59.4 tt0 -63.69 -46.28 86.23 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.338 -179.698 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 216' ' ' LEU . . . . . . . . . . . . . 14.5 tp -56.58 -46.11 80.98 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.217 -179.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 86.0 mt -63.53 -39.63 94.92 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.281 179.284 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -52.79 -45.44 67.17 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.4 -179.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 219' ' ' GLU . . . . . 0.443 ' OE1' ' O ' ' B' ' 215' ' ' GLN . 1.1 mp0 -70.44 -48.53 55.49 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.98 179.761 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -59.21 -53.4 58.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.046 -179.003 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 221' ' ' ILE . . . . . 0.437 ' N ' ' CD1' ' B' ' 221' ' ' ILE . 1.2 mp -62.27 -44.82 99.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.663 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 75.9 t80 -61.07 -49.9 75.46 Favored 'General case' 0 C--N 1.32 -0.691 0 C-N-CA 120.475 -0.49 . . . . 0.0 110.747 -179.088 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 223' ' ' HIS . . . . . . . . . . . . . 56.4 m-70 -64.06 -37.18 86.49 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.727 -179.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 9.1 t -71.69 -45.99 60.16 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.915 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -60.71 -23.63 65.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.369 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 9.8 t-80 . . . . . 0 C--N 1.331 -0.22 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.615 179.511 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 . . . . . 0 N--CA 1.465 0.314 0 CA-C-O 121.12 0.486 . . . . 0.0 110.768 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 46.0 m -59.18 -33.35 70.84 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.228 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -67.56 -49.15 64.57 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.496 179.69 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -57.95 -36.07 72.02 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.927 -0.309 . . . . 0.0 110.289 -179.826 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.71 -53.52 26.9 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 120.884 0.373 . . . . 0.0 110.492 179.637 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.08 -42.07 99.55 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.912 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 16.5 mm100 -61.32 -52.9 62.75 Favored 'General case' 0 C--O 1.239 0.509 0 CA-C-O 121.304 0.573 . . . . 0.0 110.644 -179.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 74.4 t -62.19 -47.09 94.75 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.854 179.589 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -53.13 -42.81 66.4 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 120.809 -0.356 . . . . 0.0 110.252 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 50.0 m -59.55 -43.39 93.56 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.332 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 17.6 m -64.42 -51.98 60.47 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 120.449 -0.5 . . . . 0.0 110.725 179.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.445 ' N ' ' CD1' ' A' ' 27' ' ' LEU . 7.9 mp -66.16 -20.02 66.01 Favored 'General case' 0 CA--C 1.513 -0.457 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.615 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 54.1 tt0 -74.01 -63.44 1.22 Allowed 'General case' 0 C--N 1.32 -0.687 0 O-C-N 123.418 0.449 . . . . 0.0 110.842 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -57.47 -51.96 67.32 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.939 -179.191 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.437 ' O ' ' C ' ' A' ' 31' ' ' ALA . 4.1 mm? -54.52 -39.15 67.35 Favored 'General case' 0 CA--C 1.508 -0.645 0 C-N-CA 120.876 -0.329 . . . . 0.0 110.279 -178.851 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.555 ' O ' ' C ' ' A' ' 32' ' ' THR . . . -37.67 -69.31 0.12 Allowed 'General case' 0 CA--C 1.511 -0.549 0 O-C-N 123.531 0.519 . . . . 0.0 110.062 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.555 ' C ' ' O ' ' A' ' 31' ' ' ALA . 15.9 m -5.57 111.57 0.03 OUTLIER Pre-proline 0 CA--C 1.54 0.595 0 O-C-N 124.851 1.344 . . . . 0.0 111.124 -179.334 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_exo -45.75 -42.9 19.39 Favored 'Trans proline' 0 C--N 1.309 -1.511 0 C-N-CA 122.246 1.964 . . . . 0.0 112.652 -178.008 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 67.5 m -57.66 -46.69 83.9 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.609 -179.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -67.06 -36.85 82.93 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.053 0.454 . . . . 0.0 110.179 179.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.2 -52.85 63.91 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 120.097 -0.641 . . . . 0.0 110.725 -178.047 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 64.2 ttp -62.74 -44.48 96.1 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.938 179.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 89.3 mt -60.26 -44.56 95.89 Favored 'Isoleucine or valine' 0 C--O 1.242 0.678 0 CA-C-O 121.584 0.707 . . . . 0.0 110.685 -178.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -63.84 -39.0 93.18 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.632 179.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 14.9 m -59.02 -39.32 81.57 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.797 179.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -62.31 -44.77 95.73 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.235 179.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.449 ' O ' ' N ' ' A' ' 45' ' ' GLY . 23.6 mt -62.51 -43.12 99.58 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 120.504 -0.478 . . . . 0.0 111.293 179.686 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.489 HH21 ' CG ' ' A' ' 99' ' ' ASP . 79.3 ttt-85 -40.14 -31.12 0.11 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.685 -179.703 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 78.3 m-20 -60.07 -42.3 94.25 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.267 -179.497 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.449 ' N ' ' O ' ' A' ' 42' ' ' LEU . . . 126.29 -116.08 2.46 Favored Glycine 0 CA--C 1.535 1.339 0 N-CA-C 111.384 -0.686 . . . . 0.0 111.384 179.204 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -73.95 128.83 12.7 Favored 'Trans proline' 0 N--CA 1.495 1.609 0 C-N-CA 122.271 1.981 . . . . 0.0 112.434 -179.153 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -176.33 86.46 0.27 Allowed Pre-proline 0 C--N 1.327 -0.407 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.445 179.443 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -49.35 171.12 0.08 OUTLIER 'Trans proline' 0 C--N 1.306 -1.688 0 C-N-CA 122.742 2.294 . . . . 0.0 112.281 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 70.4 t -55.4 -44.28 75.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.25 -179.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 19.0 m -61.75 -44.32 97.12 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.284 179.207 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 66.2 t0 -63.94 -40.35 96.25 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-O 121.383 0.611 . . . . 0.0 110.296 179.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.1 tt -61.31 -44.19 97.62 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.778 -0.646 . . . . 0.0 109.831 -179.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.579 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -59.21 -43.73 92.27 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 179.543 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 84.7 tt0 -54.56 -47.05 73.72 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.068 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -57.89 -49.98 74.87 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.546 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 96.8 mt -85.36 -73.76 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.522 -0.126 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.238 179.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . 0.579 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 131.74 77.37 0.14 Allowed Glycine 0 N--CA 1.461 0.331 0 N-CA-C 111.472 -0.651 . . . . 0.0 111.472 179.218 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.473 ' CB ' ' O ' ' A' ' 57' ' ' GLY . 23.2 ttm 80.93 99.26 0.06 Allowed 'General case' 0 C--O 1.234 0.239 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.955 178.867 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 179.32 22.18 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.165 179.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 55.3 mt-30 -56.92 -27.82 61.34 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 120.825 0.345 . . . . 0.0 111.135 -179.145 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 45.7 m -70.04 -45.83 66.33 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 120.931 0.396 . . . . 0.0 111.212 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.26 -29.3 70.65 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.116 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 70.0 t -72.66 -52.21 24.25 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.246 0 C-N-CA 120.546 -0.461 . . . . 0.0 110.596 179.751 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 11.1 t -55.2 -43.37 74.34 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.303 -0.559 . . . . 0.0 110.558 -179.383 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 60.0 t-80 -69.62 -49.45 53.81 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.364 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 70.1 tp60 -58.98 -45.35 90.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.58 -179.231 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.401 ' O ' ' CG ' ' A' ' 71' ' ' ARG . 3.1 mm? -63.63 -40.11 96.06 Favored 'General case' 0 CA--C 1.502 -0.878 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.479 -179.885 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 72.1 ttt180 -58.24 -43.63 87.89 Favored 'General case' 0 C--N 1.303 -1.414 0 C-N-CA 120.016 -0.673 . . . . 0.0 110.099 179.364 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 91.9 t -67.84 -53.83 27.52 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.385 179.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.599 ' O ' ' N ' ' A' ' 74' ' ' GLY . 94.2 mt -57.93 -38.38 75.83 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-N 116.151 -0.477 . . . . 0.0 109.807 -179.507 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.401 ' CG ' ' O ' ' A' ' 67' ' ' LEU . 11.0 mmm180 -59.93 -43.42 94.95 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.139 179.658 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 88.1 m-20 -64.88 -43.44 92.92 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 120.466 -0.494 . . . . 0.0 110.314 179.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -153.93 73.02 0.92 Allowed 'General case' 0 C--N 1.334 -0.067 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.755 179.28 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . 0.599 ' N ' ' O ' ' A' ' 70' ' ' LEU . . . -147.2 1.05 0.73 Allowed Glycine 0 N--CA 1.464 0.564 0 N-CA-C 110.882 -0.887 . . . . 0.0 110.882 -179.738 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.521 ' CD2' ' N ' ' A' ' 75' ' ' LEU . 3.8 mm? 55.43 61.25 2.95 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.849 0.357 . . . . 0.0 110.994 179.523 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 34.0 m -132.52 156.25 42.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.193 179.217 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.564 ' CG1' ' H ' ' A' ' 78' ' ' GLY . 60.3 t -131.83 174.04 13.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.239 -179.651 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . 0.564 ' H ' ' CG1' ' A' ' 77' ' ' VAL . . . -165.29 159.21 32.32 Favored Glycine 0 CA--C 1.526 0.739 0 N-CA-C 110.519 -1.032 . . . . 0.0 110.519 179.07 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 . . . . . 0 N--CA 1.47 0.544 0 CA-C-O 120.753 0.311 . . . . 0.0 110.697 -179.89 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 72.8 t . . . . . 0 CA--C 1.521 -0.166 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 99.7 m-85 -106.35 130.44 54.18 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.621 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 66.9 m -150.5 171.04 17.7 Favored 'General case' 0 C--N 1.341 0.2 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 49.4 mt -79.24 146.82 32.82 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.56 -179.707 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 6.0 t80 -56.08 -48.06 76.8 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.654 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 75.6 m-20 -125.47 176.39 6.85 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 116.433 -0.348 . . . . 0.0 110.291 -179.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 22.3 p -99.8 -1.84 36.57 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.323 -179.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . 0.572 ' CE1' ' CD2' ' B' ' 223' ' ' HIS . 60.8 m80 -53.61 -55.33 26.77 Favored 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 120.855 -0.338 . . . . 0.0 110.376 -179.817 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 61.4 t -44.5 -39.01 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.047 0.451 . . . . 0.0 110.322 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -71.68 -36.5 70.64 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.939 179.555 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 96.2 mm-40 -64.3 -53.28 51.44 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.188 0.518 . . . . 0.0 111.285 -178.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 3.2 pp -67.94 -39.93 83.39 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.557 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 6.4 tt -65.36 -41.37 93.88 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.226 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . 0.489 ' CG ' HH21 ' A' ' 43' ' ' ARG . 78.4 m-20 -61.86 -38.35 87.93 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.845 -179.646 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.424 ' OE2' ' OE2' ' B' ' 219' ' ' GLU . 97.9 mt-10 -71.67 -44.68 63.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.847 179.308 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -63.06 -49.83 72.99 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.57 -179.637 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 1.2 mp -63.77 -43.83 98.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.875 178.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 89.2 t80 -60.02 -47.82 84.26 Favored 'General case' 0 C--N 1.313 -0.991 0 C-N-CA 120.626 -0.43 . . . . 0.0 110.831 -179.26 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' HIS . . . . . 0.519 ' CD2' ' CE1' ' B' ' 212' ' ' HIS . 11.7 t-160 -66.65 -35.98 81.47 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.124 179.765 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 4.4 t -73.3 -49.61 26.64 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.002 0.43 . . . . 0.0 111.487 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -67.28 -21.18 65.71 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.626 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 19.8 t60 . . . . . 0 N--CA 1.452 -0.326 0 C-N-CA 120.694 -0.403 . . . . 0.0 110.426 -179.277 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 92.8 m-20 . . . . . 0 C--O 1.235 0.312 0 CA-C-O 121.222 0.534 . . . . 0.0 110.722 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 65.0 m -59.85 -33.04 71.26 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.323 179.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 -67.88 -49.52 61.55 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.467 179.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 138' ' ' ALA . . . . . . . . . . . . . . . -57.49 -35.63 70.45 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.89 -0.324 . . . . 0.0 110.287 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -67.54 -53.35 29.14 Favored 'General case' 0 CA--C 1.528 0.133 0 C-N-CA 120.759 -0.377 . . . . 0.0 110.534 179.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -63.06 -41.31 99.42 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.872 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 19.6 mm100 -62.08 -52.86 62.21 Favored 'General case' 0 C--O 1.239 0.542 0 CA-C-O 121.068 0.461 . . . . 0.0 110.603 -179.571 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 142' ' ' VAL . . . . . . . . . . . . . 84.2 t -62.28 -46.96 95.22 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 179.598 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -53.17 -43.11 66.83 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.193 179.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 69.3 m -59.17 -44.45 92.16 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.426 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 21.6 m -64.52 -51.5 62.6 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.715 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 146' ' ' LEU . . . . . 0.418 ' N ' ' CD1' ' B' ' 146' ' ' LEU . 8.3 mp -66.09 -20.16 66.07 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.681 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 147' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -74.62 -62.93 1.36 Allowed 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.889 179.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -57.91 -52.55 65.01 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.138 -179.12 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.427 ' O ' ' C ' ' B' ' 150' ' ' ALA . 4.2 mm? -53.78 -37.57 63.58 Favored 'General case' 0 CA--C 1.508 -0.665 0 C-N-CA 120.794 -0.362 . . . . 0.0 110.194 -178.884 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 150' ' ' ALA . . . . . 0.552 ' O ' ' C ' ' B' ' 151' ' ' THR . . . -39.31 -70.16 0.11 Allowed 'General case' 0 CA--C 1.511 -0.543 0 O-C-N 123.483 0.49 . . . . 0.0 110.136 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 151' ' ' THR . . . . . 0.552 ' C ' ' O ' ' B' ' 150' ' ' ALA . 11.2 m -5.19 111.43 0.03 OUTLIER Pre-proline 0 N--CA 1.471 0.624 0 O-C-N 124.827 1.329 . . . . 0.0 111.07 -179.301 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -45.55 -42.43 18.46 Favored 'Trans proline' 0 C--N 1.307 -1.634 0 C-N-CA 122.26 1.973 . . . . 0.0 112.686 -177.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 73.0 m -58.02 -45.89 86.18 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.53 -179.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 92.9 mtt180 -68.17 -37.08 80.6 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.191 0.519 . . . . 0.0 110.251 179.55 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 155' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.86 -52.88 63.55 Favored 'General case' 0 C--N 1.32 -0.703 0 C-N-CA 120.032 -0.667 . . . . 0.0 111.009 -178.155 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 65.5 ttp -62.83 -44.13 96.96 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.706 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 80.3 mt -60.38 -44.58 96.34 Favored 'Isoleucine or valine' 0 C--O 1.241 0.636 0 CA-C-O 121.478 0.656 . . . . 0.0 110.465 -179.144 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -63.38 -39.81 95.53 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.662 179.335 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 25.0 m -57.94 -39.89 79.16 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.725 179.594 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 98.9 mm-40 -61.71 -45.1 95.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.236 179.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 161' ' ' LEU . . . . . 0.431 ' O ' ' N ' ' B' ' 164' ' ' GLY . 21.8 mt -62.8 -43.13 99.62 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 120.442 -0.503 . . . . 0.0 111.256 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 162' ' ' ARG . . . . . 0.487 HH21 ' CG ' ' B' ' 218' ' ' ASP . 78.9 ttt-85 -40.46 -30.15 0.1 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.736 -179.834 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 82.3 m-20 -60.48 -42.66 96.71 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.293 -179.333 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 164' ' ' GLY . . . . . 0.431 ' N ' ' O ' ' B' ' 161' ' ' LEU . . . 127.57 -114.89 2.0 Favored Glycine 0 CA--C 1.538 1.469 0 N-CA-C 111.191 -0.764 . . . . 0.0 111.191 179.252 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -75.8 129.09 11.34 Favored 'Trans proline' 0 N--CA 1.494 1.552 0 C-N-CA 122.4 2.067 . . . . 0.0 112.331 -179.537 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -175.91 84.14 0.29 Allowed Pre-proline 0 C--N 1.327 -0.394 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.242 179.457 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 55.1 Cg_exo -48.1 171.79 0.05 OUTLIER 'Trans proline' 0 C--N 1.305 -1.72 0 C-N-CA 122.756 2.304 . . . . 0.0 112.3 -179.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . 72.3 t -55.26 -44.96 77.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.317 -179.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 169' ' ' THR . . . . . . . . . . . . . 13.2 m -62.36 -44.46 96.42 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.367 179.18 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 64.3 t0 -63.3 -39.92 95.9 Favored 'General case' 0 C--O 1.24 0.553 0 CA-C-O 121.433 0.635 . . . . 0.0 110.162 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 4.5 tt -62.12 -43.91 97.81 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.81 -179.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 172' ' ' ALA . . . . . 0.577 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -59.42 -43.94 92.98 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 179.717 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 82.2 tt0 -54.46 -46.78 73.38 Favored 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 120.615 -0.434 . . . . 0.0 109.996 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -58.7 -50.76 72.7 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 120.683 -0.407 . . . . 0.0 110.693 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 93.8 mt -83.97 -73.53 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.102 179.617 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 176' ' ' GLY . . . . . 0.577 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 131.34 77.9 0.16 Allowed Glycine 0 C--N 1.332 0.309 0 N-CA-C 111.567 -0.613 . . . . 0.0 111.567 179.429 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 177' ' ' MET . . . . . 0.456 ' CB ' ' O ' ' B' ' 176' ' ' GLY . 23.9 ttm 79.94 99.39 0.06 Allowed 'General case' 0 C--O 1.233 0.229 0 C-N-CA 120.801 -0.36 . . . . 0.0 111.01 178.793 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 178' ' ' GLU . . . . . 0.424 ' OE1' ' O ' ' B' ' 177' ' ' MET . 1.3 tp10 179.45 22.97 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.18 179.632 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 51.2 mt-30 -57.82 -27.12 62.88 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 120.897 0.38 . . . . 0.0 111.027 -179.124 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 69.6 m -70.41 -45.99 64.84 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.159 179.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -63.47 -29.28 70.59 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.119 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 84.4 t -72.51 -52.41 23.67 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.305 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.45 179.669 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 9.5 t -55.12 -43.13 73.8 Favored 'General case' 0 C--N 1.32 -0.701 0 C-N-CA 120.282 -0.567 . . . . 0.0 110.614 -179.52 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 -69.98 -49.63 49.78 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.329 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 68.4 tp60 -59.02 -45.34 90.96 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.016 0.436 . . . . 0.0 110.652 -179.195 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -63.57 -40.36 96.77 Favored 'General case' 0 CA--C 1.502 -0.893 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.32 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 72.9 ttt180 -58.43 -43.75 88.86 Favored 'General case' 0 C--N 1.304 -1.394 0 C-N-CA 120.08 -0.648 . . . . 0.0 110.242 179.41 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 84.0 t -67.49 -53.5 31.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.169 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.102 179.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 189' ' ' LEU . . . . . 0.589 ' O ' ' N ' ' B' ' 193' ' ' GLY . 94.6 mt -57.73 -38.45 75.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.27 0.557 . . . . 0.0 109.741 -179.513 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 8.9 mmm180 -59.72 -44.13 93.87 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.302 179.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 87.8 m-20 -64.42 -42.86 95.81 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.424 -0.51 . . . . 0.0 110.261 179.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 192' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -154.78 74.56 0.94 Allowed 'General case' 0 C--O 1.23 0.065 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.692 179.292 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 193' ' ' GLY . . . . . 0.589 ' N ' ' O ' ' B' ' 189' ' ' LEU . . . -148.38 0.73 0.59 Allowed Glycine 0 N--CA 1.463 0.471 0 N-CA-C 110.921 -0.872 . . . . 0.0 110.921 -179.648 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 194' ' ' LEU . . . . . 0.535 ' CD2' ' N ' ' B' ' 194' ' ' LEU . 3.7 mm? 56.28 60.44 3.16 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.814 0.34 . . . . 0.0 110.869 179.585 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 34.4 m -131.82 154.72 40.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.205 179.232 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 196' ' ' VAL . . . . . 0.435 ' CG2' ' CD2' ' B' ' 209' ' ' TYR . 54.0 t -136.61 155.9 34.61 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.28 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.541 -179.379 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 197' ' ' GLY . . . . . . . . . . . . . . . -145.67 158.74 27.76 Favored Glycine 0 CA--C 1.521 0.426 0 N-CA-C 110.341 -1.103 . . . . 0.0 110.341 179.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 . . . . . 0 N--CA 1.469 0.505 0 CA-C-O 120.941 0.4 . . . . 0.0 110.677 -179.807 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 83.2 t . . . . . 0 C--O 1.225 -0.197 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 98.9 m-85 -105.45 130.66 53.48 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.557 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 69.9 m -150.82 171.52 17.09 Favored 'General case' 0 C--O 1.227 -0.12 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . 41.1 mt -79.04 147.44 32.84 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.535 -179.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 209' ' ' TYR . . . . . 0.435 ' CD2' ' CG2' ' B' ' 196' ' ' VAL . 5.9 t80 -55.66 -48.48 74.96 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.715 -0.394 . . . . 0.0 110.348 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 80.4 m-20 -124.74 -178.54 4.18 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 -179.716 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 66.6 p -104.02 -2.68 25.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.362 -179.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 212' ' ' HIS . . . . . 0.519 ' CE1' ' CD2' ' A' ' 104' ' ' HIS . 65.5 m80 -52.62 -54.98 25.73 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.332 -179.769 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 10.6 t -44.67 -40.01 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 121.039 0.447 . . . . 0.0 110.282 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 214' ' ' ALA . . . . . . . . . . . . . . . -71.61 -36.75 70.89 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.906 179.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 97.5 mm-40 -64.24 -53.76 43.99 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.227 0.537 . . . . 0.0 111.223 -178.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 216' ' ' LEU . . . . . . . . . . . . . 3.1 pp -67.29 -40.08 86.07 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.621 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 6.3 tt -65.05 -42.33 94.35 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.467 -179.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 218' ' ' ASP . . . . . 0.487 ' CG ' HH21 ' B' ' 162' ' ' ARG . 93.5 m-20 -61.13 -37.9 84.47 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.027 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 219' ' ' GLU . . . . . 0.424 ' OE2' ' OE2' ' A' ' 100' ' ' GLU . 97.2 mt-10 -71.79 -42.59 66.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.854 179.194 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -65.71 -49.37 68.73 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.006 0.432 . . . . 0.0 110.642 -179.747 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 1.3 mp -63.99 -43.02 97.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.331 179.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 89.1 t80 -60.37 -48.12 83.1 Favored 'General case' 0 C--N 1.314 -0.952 0 C-N-CA 120.609 -0.437 . . . . 0.0 110.939 -179.28 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 223' ' ' HIS . . . . . 0.572 ' CD2' ' CE1' ' A' ' 93' ' ' HIS . 12.0 t-160 -67.07 -35.15 79.19 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.15 179.759 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 23.3 t -74.18 -50.29 19.9 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.952 0.406 . . . . 0.0 111.336 -179.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 71.9 mm-40 -66.73 -22.01 66.06 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.673 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 10.5 t60 . . . . . 0 N--CA 1.453 -0.293 0 C-N-CA 120.664 -0.415 . . . . 0.0 110.487 -179.221 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 30.8 m-20 . . . . . 0 C--O 1.245 0.82 0 CA-C-O 121.052 0.454 . . . . 0.0 110.678 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 10.2 t -53.64 -57.71 9.79 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.387 -178.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 17.2 mp0 -44.98 -47.46 11.46 Favored 'General case' 0 C--O 1.21 -0.992 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 179.291 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -50.58 -56.45 11.65 Favored 'General case' 0 C--O 1.242 0.664 0 C-N-CA 120.425 -0.51 . . . . 0.0 110.008 -178.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.17 -53.5 48.34 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.756 179.453 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -51.3 -47.64 62.53 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.778 -179.439 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 70.8 tp60 -54.48 -51.98 63.35 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-O 120.921 0.391 . . . . 0.0 110.274 -179.266 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 88.8 t -64.34 -47.53 89.22 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.53 179.779 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.04 -44.87 83.35 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.092 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 11.3 t -56.05 -42.78 77.13 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 26.3 m -60.11 -50.33 74.14 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.476 179.424 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.467 ' N ' ' CD1' ' A' ' 27' ' ' LEU . 7.2 mp -68.06 -23.21 64.93 Favored 'General case' 0 CA--C 1.522 -0.128 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.572 179.214 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 52.7 tt0 -70.89 -66.81 0.56 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.321 -179.707 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.62 -53.54 57.18 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.882 0.372 . . . . 0.0 110.438 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.503 ' O ' ' O ' ' A' ' 31' ' ' ALA . 46.3 tp -45.2 -28.41 0.77 Allowed 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.631 -179.5 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.503 ' O ' ' O ' ' A' ' 30' ' ' LEU . . . -56.22 -124.4 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.29 179.387 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.464 ' O ' ' O ' ' A' ' 31' ' ' ALA . 85.5 m 55.77 111.26 0.02 OUTLIER Pre-proline 0 C--N 1.324 -0.516 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.319 179.263 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -48.42 -47.99 18.51 Favored 'Trans proline' 0 C--N 1.305 -1.715 0 C-N-CA 122.496 2.131 . . . . 0.0 112.605 -178.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 65.1 m -62.09 -46.62 88.29 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.174 -179.058 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 53.1 ttm-85 -61.21 -45.25 95.36 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.699 -178.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 1.4 tt -59.97 -52.78 63.94 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.666 -0.414 . . . . 0.0 110.343 -178.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 11.3 tpt -51.24 -47.79 62.29 Favored 'General case' 0 C--O 1.238 0.475 0 C-N-CA 120.63 -0.428 . . . . 0.0 110.035 -179.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.425 HG22 HD11 ' A' ' 38' ' ' ILE . 35.4 mm -63.34 -43.09 98.43 Favored 'Isoleucine or valine' 0 C--O 1.246 0.883 0 CA-C-O 121.101 0.477 . . . . 0.0 110.652 179.461 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.46 -43.7 98.19 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.758 -179.422 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 19.3 m -58.29 -40.46 82.0 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.913 179.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 60.7 tp60 -58.0 -45.55 86.67 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.113 179.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 11.4 mt -65.42 -39.21 91.86 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.255 178.105 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 3.4 tmt_? -53.64 -46.07 70.4 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.583 -178.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 29.2 t-20 -61.44 -38.79 88.45 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.994 0.426 . . . . 0.0 110.226 179.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -173.55 157.11 25.4 Favored Glycine 0 CA--C 1.527 0.8 0 N-CA-C 111.074 -0.811 . . . . 0.0 111.074 179.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.446 ' O ' ' O ' ' A' ' 47' ' ' LEU . 51.9 Cg_endo -71.34 -74.58 0.01 OUTLIER 'Trans proline' 0 C--N 1.31 -1.49 0 C-N-CA 122.727 2.285 . . . . 0.0 112.697 179.769 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.446 ' O ' ' O ' ' A' ' 46' ' ' PRO . 0.5 OUTLIER 59.57 144.59 0.05 OUTLIER Pre-proline 0 C--N 1.321 -0.643 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.022 178.306 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -67.54 167.28 21.25 Favored 'Trans proline' 0 C--N 1.305 -1.712 0 C-N-CA 122.554 2.169 . . . . 0.0 111.877 178.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.467 ' O ' ' OE1' ' A' ' 60' ' ' GLN . 66.9 t -58.69 -41.77 83.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.131 -179.925 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -60.28 -41.5 93.47 Favored 'General case' 0 C--O 1.248 0.991 0 CA-C-O 121.471 0.653 . . . . 0.0 110.69 179.78 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -64.96 -38.66 91.69 Favored 'General case' 0 C--O 1.239 0.551 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.04 179.664 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 17.9 mt -62.44 -35.23 78.63 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.342 179.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.495 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -60.96 -46.33 91.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.785 178.678 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 70.3 mm-40 -57.61 -47.95 80.75 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 120.484 -0.487 . . . . 0.0 110.28 179.751 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.14 -44.58 88.16 Favored 'General case' 0 C--O 1.232 0.166 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.447 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 97.4 mt -97.62 -80.05 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.461 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . 0.495 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 156.94 103.19 0.2 Allowed Glycine 0 CA--C 1.526 0.723 0 N-CA-C 110.767 -0.933 . . . . 0.0 110.767 -179.624 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.517 ' O ' ' NE2' ' A' ' 60' ' ' GLN . 70.2 mmm 43.3 -114.84 0.34 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.109 0.481 . . . . 0.0 110.471 179.723 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 50.33 13.17 0.11 Allowed 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.417 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . 0.517 ' NE2' ' O ' ' A' ' 58' ' ' MET . 3.2 mm-40 -50.85 -29.59 12.21 Favored 'General case' 0 C--O 1.238 0.498 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.667 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 3.0 t -72.98 -33.88 66.11 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.298 179.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.5 -38.96 74.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.123 -178.583 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 12.5 m -71.06 -47.02 63.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.568 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 11.0 t -58.16 -43.96 87.67 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 -179.7 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -64.61 -51.05 64.72 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.845 179.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -61.72 -39.84 92.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.6 179.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.3 tp -60.91 -43.56 98.38 Favored 'General case' 0 C--O 1.218 -0.596 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.038 -179.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 72.3 ttt180 -60.73 -42.23 96.89 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-O 120.829 0.347 . . . . 0.0 110.316 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 85.7 t -59.97 -54.75 30.42 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 C-N-CA 120.446 -0.502 . . . . 0.0 110.132 -179.201 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.423 ' CD2' ' N ' ' A' ' 70' ' ' LEU . 4.3 mm? -64.12 -37.83 88.86 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.584 179.079 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 60.1 ttt85 -52.25 -41.7 63.04 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.121 -179.477 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 -56.86 -45.75 82.27 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 120.587 -0.445 . . . . 0.0 110.293 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.0 mt -67.83 -39.06 83.93 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 110.021 -0.363 . . . . 0.0 110.021 179.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 96.74 46.47 2.48 Favored Glycine 0 CA--C 1.52 0.364 0 N-CA-C 110.989 -0.845 . . . . 0.0 110.989 -179.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 5.0 tp -105.78 -9.21 17.36 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.91 0.386 . . . . 0.0 110.763 -179.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.9 m -135.65 160.22 39.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.508 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -153.59 174.63 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.91 -179.703 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -143.85 156.48 26.68 Favored Glycine 0 C--N 1.332 0.34 0 N-CA-C 110.825 -0.91 . . . . 0.0 110.825 179.169 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 . . . . . 0 N--CA 1.466 0.349 0 CA-C-O 120.768 0.318 . . . . 0.0 110.4 -179.885 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 3.3 m . . . . . 0 N--CA 1.467 0.422 0 CA-C-O 120.622 0.249 . . . . 0.0 110.767 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 71.7 m-85 -89.96 119.07 30.01 Favored 'General case' 0 C--O 1.22 -0.495 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.054 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 66.6 m -133.04 152.59 51.95 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-O 120.966 0.412 . . . . 0.0 110.385 -179.321 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.703 ' CD2' ' H ' ' A' ' 89' ' ' LEU . 0.5 OUTLIER -73.03 137.6 45.45 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.526 179.927 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 66.3 t80 -61.71 -50.31 72.94 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.736 -179.644 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 39.6 t0 -89.75 130.49 36.01 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.793 -179.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 11.8 m -93.45 -28.98 15.8 Favored 'General case' 0 C--O 1.244 0.777 0 CA-C-O 121.309 0.576 . . . . 0.0 110.389 179.345 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . 0.579 ' CG ' ' CD2' ' B' ' 223' ' ' HIS . 75.9 m80 -55.21 -46.06 75.9 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.122 179.817 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.448 ' CG1' ' N ' ' A' ' 95' ' ' ALA . 13.1 p -53.05 -44.21 50.27 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.203 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . 0.448 ' N ' ' CG1' ' A' ' 94' ' ' VAL . . . -57.08 -37.2 71.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.065 179.124 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -64.06 -38.93 92.87 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-O 121.23 0.538 . . . . 0.0 110.175 179.304 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 50.2 mt -61.21 -44.55 97.1 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.248 179.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.407 ' N ' ' CD2' ' A' ' 98' ' ' LEU . 4.2 mm? -66.94 -37.06 83.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.832 178.52 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -57.51 -47.26 82.43 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.189 -179.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.457 ' OE2' ' OE2' ' B' ' 219' ' ' GLU . 97.7 mt-10 -69.87 -52.31 25.84 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.548 179.238 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -53.3 -46.82 69.53 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.519 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 4.8 mm -62.52 -44.53 99.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.352 -179.377 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' TYR . . . . . 0.633 ' CE1' ' NE2' ' A' ' 107' ' ' HIS . 85.1 t80 -60.84 -46.89 88.78 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.989 0.423 . . . . 0.0 110.421 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' HIS . . . . . 0.55 ' CD2' ' CG ' ' B' ' 212' ' ' HIS . 18.3 t-80 -57.0 -39.73 75.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.614 -179.82 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 36.1 t -76.28 -40.35 51.96 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.161 179.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -56.78 -33.96 67.15 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.408 -179.213 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . 0.633 ' NE2' ' CE1' ' A' ' 103' ' ' TYR . 9.2 m-70 . . . . . 0 C--N 1.326 -0.437 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.513 179.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 . . . . . 0 C--O 1.247 0.927 0 CA-C-O 121.196 0.522 . . . . 0.0 110.725 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 10.0 t -54.07 -57.18 12.05 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.379 -178.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 14.0 mp0 -46.01 -47.27 16.82 Favored 'General case' 0 C--O 1.209 -1.038 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 179.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 138' ' ' ALA . . . . . . . . . . . . . . . -50.04 -56.25 11.55 Favored 'General case' 0 C--O 1.242 0.706 0 C-N-CA 120.423 -0.511 . . . . 0.0 109.998 -178.348 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -64.5 -53.15 52.65 Favored 'General case' 0 N--CA 1.457 -0.108 0 C-N-CA 120.381 -0.528 . . . . 0.0 110.784 179.387 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -51.44 -46.13 62.9 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.875 -179.266 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 68.9 tp60 -55.75 -52.86 62.49 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 120.862 0.363 . . . . 0.0 110.171 -179.291 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 142' ' ' VAL . . . . . . . . . . . . . 90.4 t -63.51 -46.84 94.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.451 179.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -57.55 -45.75 84.74 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.394 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 11.3 t -56.07 -41.72 75.55 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 19.3 m -60.64 -49.05 79.06 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.358 179.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 146' ' ' LEU . . . . . 0.467 ' N ' ' CD1' ' B' ' 146' ' ' LEU . 7.3 mp -69.44 -22.33 63.67 Favored 'General case' 0 CA--C 1.522 -0.122 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.572 179.172 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 147' ' ' GLN . . . . . . . . . . . . . 54.4 tt0 -71.58 -66.04 0.68 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.195 -179.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -59.17 -53.64 56.06 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.833 0.349 . . . . 0.0 110.321 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.52 ' O ' ' O ' ' B' ' 150' ' ' ALA . 39.0 tp -45.8 -29.45 1.34 Allowed 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.548 -179.703 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 150' ' ' ALA . . . . . 0.52 ' O ' ' O ' ' B' ' 149' ' ' LEU . . . -55.46 -125.54 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.36 179.535 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 151' ' ' THR . . . . . 0.463 ' O ' ' O ' ' B' ' 150' ' ' ALA . 90.9 m 56.25 112.73 0.02 OUTLIER Pre-proline 0 N--CA 1.446 -0.633 0 CA-C-N 116.508 -0.314 . . . . 0.0 110.326 179.332 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -48.56 -49.14 15.32 Favored 'Trans proline' 0 C--N 1.305 -1.731 0 C-N-CA 122.47 2.113 . . . . 0.0 112.811 -179.284 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 46.0 m -61.49 -46.64 89.15 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.043 -178.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 54.0 ttm-85 -61.33 -44.88 96.45 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.669 -178.541 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 155' ' ' LEU . . . . . . . . . . . . . 1.8 tt -60.47 -52.63 64.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.342 -178.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 11.3 tpt -51.17 -47.56 62.12 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 120.607 -0.437 . . . . 0.0 109.981 -179.59 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 35.5 mm -63.52 -42.67 96.98 Favored 'Isoleucine or valine' 0 C--O 1.247 0.967 0 CA-C-O 121.123 0.487 . . . . 0.0 110.636 179.216 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.57 -42.84 99.8 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.796 -179.447 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 9.2 m -59.15 -41.92 89.5 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.786 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 60.2 tp60 -56.56 -45.77 81.1 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 121.002 0.429 . . . . 0.0 110.298 179.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 161' ' ' LEU . . . . . . . . . . . . . 12.7 mt -65.7 -38.3 88.87 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.195 178.316 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 162' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -55.29 -44.27 75.57 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.581 -178.59 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -63.69 -39.24 93.83 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.233 179.214 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . -172.66 155.53 23.3 Favored Glycine 0 CA--C 1.528 0.884 0 N-CA-C 111.111 -0.796 . . . . 0.0 111.111 179.547 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 165' ' ' PRO . . . . . 0.43 ' O ' ' O ' ' B' ' 166' ' ' LEU . 49.4 Cg_endo -70.74 -75.56 0.01 OUTLIER 'Trans proline' 0 C--N 1.31 -1.453 0 C-N-CA 122.761 2.307 . . . . 0.0 112.583 179.736 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 166' ' ' LEU . . . . . 0.43 ' O ' ' O ' ' B' ' 165' ' ' PRO . 0.4 OUTLIER 60.08 144.07 0.05 OUTLIER Pre-proline 0 C--N 1.32 -0.675 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.028 178.319 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -66.6 167.14 19.81 Favored 'Trans proline' 0 C--N 1.305 -1.757 0 C-N-CA 122.58 2.186 . . . . 0.0 112.127 179.504 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 168' ' ' VAL . . . . . 0.464 ' O ' ' OE1' ' B' ' 179' ' ' GLN . 55.0 t -58.24 -41.93 82.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.897 -179.923 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 169' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -60.2 -41.74 93.63 Favored 'General case' 0 C--O 1.247 0.931 0 CA-C-O 121.501 0.667 . . . . 0.0 110.701 179.69 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -64.5 -38.45 91.06 Favored 'General case' 0 C--O 1.239 0.527 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.127 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 18.9 mt -62.14 -36.1 80.78 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.356 179.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 172' ' ' ALA . . . . . 0.474 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -60.66 -46.27 90.98 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.922 178.936 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -57.76 -48.13 80.54 Favored 'General case' 0 C--O 1.236 0.342 0 C-N-CA 120.553 -0.459 . . . . 0.0 110.285 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -65.03 -45.57 84.88 Favored 'General case' 0 C--O 1.232 0.163 0 C-N-CA 120.696 -0.402 . . . . 0.0 110.633 179.712 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 97.0 mt -96.8 -79.08 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.604 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 176' ' ' GLY . . . . . 0.474 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 156.86 103.3 0.2 Allowed Glycine 0 CA--C 1.525 0.666 0 N-CA-C 110.74 -0.944 . . . . 0.0 110.74 -179.683 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 177' ' ' MET . . . . . 0.538 ' O ' ' NE2' ' B' ' 179' ' ' GLN . 74.7 mtp 41.35 -113.16 0.18 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.181 0.515 . . . . 0.0 110.578 179.823 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 50.09 11.9 0.07 Allowed 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.305 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 179' ' ' GLN . . . . . 0.538 ' NE2' ' O ' ' B' ' 177' ' ' MET . 2.7 mm-40 -48.74 -29.33 4.37 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.752 179.778 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 38.9 m -73.04 -33.93 65.99 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.307 179.704 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -70.02 -38.87 76.02 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.119 -178.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 182' ' ' VAL . . . . . 0.445 ' H ' HG23 ' B' ' 182' ' ' VAL . 11.0 m -71.42 -47.19 60.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.483 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 10.5 t -57.73 -44.1 85.77 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 86.1 t60 -65.58 -51.71 57.68 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.809 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -60.99 -41.54 96.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.534 179.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 7.5 tp -59.53 -44.21 93.26 Favored 'General case' 0 C--O 1.216 -0.665 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.201 -179.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 72.9 ttt180 -60.09 -42.64 95.07 Favored 'General case' 0 C--O 1.242 0.671 0 CA-C-O 120.991 0.424 . . . . 0.0 110.414 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 88.7 t -59.46 -54.46 34.08 Favored 'Isoleucine or valine' 0 C--O 1.232 0.135 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.012 -179.211 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 189' ' ' LEU . . . . . 0.456 ' N ' ' CD2' ' B' ' 189' ' ' LEU . 4.1 mm? -64.42 -38.08 89.78 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.572 178.872 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 61.2 ttt85 -51.23 -39.72 57.25 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.321 -179.608 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -60.36 -40.1 89.56 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.809 0.337 . . . . 0.0 110.237 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 192' ' ' LEU . . . . . . . . . . . . . 7.4 mt -71.59 -37.72 70.96 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.489 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 95.19 42.5 3.73 Favored Glycine 0 CA--C 1.522 0.502 0 N-CA-C 110.766 -0.934 . . . . 0.0 110.766 -179.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 5.1 tp -103.99 -9.55 18.77 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.794 0.33 . . . . 0.0 110.921 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 3.4 m -135.71 159.78 39.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.659 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 196' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -155.2 176.39 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.823 -179.83 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 197' ' ' GLY . . . . . . . . . . . . . . . -145.47 158.3 27.61 Favored Glycine 0 CA--C 1.52 0.397 0 N-CA-C 110.723 -0.951 . . . . 0.0 110.723 179.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 . . . . . 0 N--CA 1.466 0.375 0 CA-C-O 120.673 0.273 . . . . 0.0 110.368 -179.881 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 3.0 m . . . . . 0 N--CA 1.466 0.345 0 CA-C-O 120.568 0.223 . . . . 0.0 110.719 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 71.9 m-85 -90.37 118.33 29.78 Favored 'General case' 0 C--O 1.219 -0.533 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.005 -179.776 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 63.7 m -133.46 152.68 51.94 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.013 0.435 . . . . 0.0 110.327 -179.309 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 208' ' ' LEU . . . . . 0.689 ' CD2' ' H ' ' B' ' 208' ' ' LEU . 0.5 OUTLIER -73.37 136.52 44.39 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.652 179.845 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 63.4 t80 -61.68 -47.65 84.36 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.554 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -90.29 129.36 36.53 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.695 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 23.6 m -94.02 -31.06 14.39 Favored 'General case' 0 C--O 1.244 0.808 0 CA-C-O 121.334 0.587 . . . . 0.0 110.304 179.43 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 212' ' ' HIS . . . . . 0.55 ' CG ' ' CD2' ' A' ' 104' ' ' HIS . 75.3 m80 -54.44 -45.09 73.0 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 115.89 -0.595 . . . . 0.0 109.995 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 213' ' ' VAL . . . . . 0.438 ' CG1' ' N ' ' B' ' 214' ' ' ALA . 13.1 p -52.82 -43.67 46.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.054 0.454 . . . . 0.0 110.124 179.836 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 214' ' ' ALA . . . . . 0.438 ' N ' ' CG1' ' B' ' 213' ' ' VAL . . . -57.69 -38.12 74.64 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.014 179.053 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 57.2 tt0 -62.72 -39.5 94.26 Favored 'General case' 0 C--O 1.238 0.459 0 CA-C-O 121.258 0.551 . . . . 0.0 110.119 179.318 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 216' ' ' LEU . . . . . . . . . . . . . 48.9 mt -61.38 -44.87 96.41 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.298 179.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 217' ' ' LEU . . . . . 0.401 ' N ' ' CD2' ' B' ' 217' ' ' LEU . 4.1 mm? -66.45 -37.3 84.84 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.886 178.383 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -57.59 -47.36 82.32 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.14 -179.042 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 219' ' ' GLU . . . . . 0.457 ' OE2' ' OE2' ' A' ' 100' ' ' GLU . 94.6 mt-10 -69.91 -51.5 32.49 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.607 179.185 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -53.64 -47.68 70.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.459 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 4.4 mm -62.07 -44.76 99.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.432 -179.251 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 222' ' ' TYR . . . . . 0.593 ' CE1' ' NE2' ' B' ' 226' ' ' HIS . 74.5 t80 -60.09 -47.37 86.16 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.943 0.402 . . . . 0.0 110.427 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 223' ' ' HIS . . . . . 0.579 ' CD2' ' CG ' ' A' ' 93' ' ' HIS . 17.7 t-80 -56.75 -39.24 73.64 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.586 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 32.9 t -76.74 -40.53 48.19 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.066 179.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 82.9 tt0 -56.78 -34.85 68.03 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.355 -179.254 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 226' ' ' HIS . . . . . 0.593 ' NE2' ' CE1' ' B' ' 222' ' ' TYR . 8.0 m-70 . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.483 179.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . 0.523 ' O ' ' N ' ' A' ' 19' ' ' ALA . 98.9 m-20 . . . . . 0 C--O 1.232 0.161 0 CA-C-O 120.6 0.238 . . . . 0.0 110.722 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.405 ' C ' ' O ' ' A' ' 16' ' ' ASP . 91.3 p -38.31 -38.5 0.36 Allowed 'General case' 0 C--O 1.24 0.583 0 CA-C-O 121.231 0.539 . . . . 0.0 110.6 -179.509 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 25.1 pt20 -65.33 -44.02 89.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.328 179.144 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.523 ' N ' ' O ' ' A' ' 16' ' ' ASP . . . -63.67 -28.6 70.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.202 179.456 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.36 -51.73 48.64 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.239 179.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.06 -46.5 89.36 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.71 179.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -54.48 -50.58 67.42 Favored 'General case' 0 C--O 1.241 0.648 0 CA-C-O 121.177 0.513 . . . . 0.0 110.471 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 92.2 t -62.76 -44.73 99.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.42 179.573 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -53.6 -44.05 69.11 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 10.9 t -59.91 -43.88 94.6 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 11.1 m -63.73 -46.95 83.06 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.025 0.441 . . . . 0.0 110.39 179.289 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 95.4 mt -67.26 -21.12 65.73 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.643 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 58.2 tt0 -75.81 -56.36 4.75 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.637 179.329 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.12 -54.61 45.02 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.448 -179.466 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.486 ' O ' ' O ' ' A' ' 31' ' ' ALA . 93.3 mt -47.56 -41.96 22.56 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.557 -179.205 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.517 ' O ' ' CB ' ' A' ' 32' ' ' THR . . . -50.04 -174.97 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.017 179.752 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.517 ' CB ' ' O ' ' A' ' 31' ' ' ALA . 1.0 OUTLIER 88.37 118.3 0.03 OUTLIER Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.031 179.961 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -46.7 -46.58 17.69 Favored 'Trans proline' 0 N--CA 1.496 1.659 0 C-N-CA 122.368 2.045 . . . . 0.0 113.113 -178.662 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 11.6 t -58.97 -44.5 91.55 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.813 -179.118 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 22.5 mmt85 -62.0 -46.15 90.46 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 120.675 -0.41 . . . . 0.0 110.984 -179.315 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.467 ' CD2' ' O ' ' A' ' 30' ' ' LEU . 4.2 mm? -62.87 -47.31 83.88 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.974 -179.567 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.444 ' C ' ' SD ' ' A' ' 37' ' ' MET . 14.3 tmm? -58.32 -49.22 77.97 Favored 'General case' 0 C--N 1.32 -0.677 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.545 -179.673 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.409 HG23 HD12 ' A' ' 38' ' ' ILE . 32.9 mm -63.96 -44.62 97.96 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.789 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 49.3 mt -62.12 -42.35 99.14 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.754 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.422 ' OG1' ' O ' ' A' ' 36' ' ' LEU . 19.5 m -60.16 -41.32 92.56 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.2 -0.455 . . . . 0.0 109.896 179.554 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.539 ' N ' ' OE1' ' A' ' 41' ' ' GLN . 0.1 OUTLIER -57.85 -49.68 75.86 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.262 -0.426 . . . . 0.0 109.928 179.992 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 98.3 mt -63.77 -42.55 97.76 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.455 -0.498 . . . . 0.0 110.685 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 72.7 ttp85 -71.53 -21.12 61.95 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.646 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 62.0 t-20 -62.46 -41.22 98.61 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.934 0.397 . . . . 0.0 110.48 -179.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 159.34 -166.59 34.78 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 111.088 -0.805 . . . . 0.0 111.088 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_exo -73.51 115.51 4.36 Favored 'Trans proline' 0 N--CA 1.492 1.415 0 C-N-CA 122.888 2.392 . . . . 0.0 112.151 179.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.449 ' O ' ' O ' ' A' ' 48' ' ' PRO . 0.3 OUTLIER -158.34 84.61 2.58 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.106 179.911 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . 0.449 ' O ' ' O ' ' A' ' 47' ' ' LEU . 51.2 Cg_exo -51.14 -166.57 0.0 OUTLIER 'Trans proline' 0 C--N 1.303 -1.855 0 C-N-CA 122.471 2.114 . . . . 0.0 112.385 179.699 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 55.0 t -59.69 -51.06 77.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 121.072 0.463 . . . . 0.0 111.291 -179.265 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -57.33 -44.84 84.57 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.257 0.551 . . . . 0.0 109.921 179.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 -65.09 -33.99 77.34 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.592 -0.522 . . . . 0.0 109.592 179.429 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.05 -43.26 99.21 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 120.541 -0.463 . . . . 0.0 110.09 -179.777 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.81 -45.04 96.01 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.587 179.407 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 41.1 tp10 -65.03 -30.42 71.4 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.369 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -70.28 -53.98 14.56 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.853 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 90.2 mt -94.26 -68.67 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.247 179.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 134.2 97.72 0.6 Allowed Glycine 0 C--N 1.332 0.322 0 N-CA-C 111.348 -0.701 . . . . 0.0 111.348 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 65.6 mtt 60.02 97.38 0.03 OUTLIER 'General case' 0 CA--C 1.519 -0.212 0 C-N-CA 120.819 -0.352 . . . . 0.0 110.928 178.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -179.6 19.15 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.488 179.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 56.0 mt-30 -54.4 -26.72 32.16 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.365 0.602 . . . . 0.0 110.797 -179.047 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 78.1 p -74.39 -31.48 62.36 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.237 179.353 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -74.6 -38.98 62.46 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.446 -178.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.407 ' CG1' ' N ' ' A' ' 64' ' ' SER . 7.6 p -73.81 -50.63 28.21 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 CA-C-N 116.515 -0.312 . . . . 0.0 110.381 179.898 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.407 ' N ' ' CG1' ' A' ' 63' ' ' VAL . 45.4 t -58.37 -43.76 88.58 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 120.509 -0.477 . . . . 0.0 110.362 -179.787 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 55.6 t-80 -67.0 -45.55 77.24 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.859 179.686 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -63.86 -48.49 76.51 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.974 -179.192 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -61.84 -44.55 96.62 Favored 'General case' 0 CA--C 1.503 -0.829 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.877 -179.343 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 60.8 ttp180 -59.55 -44.35 93.27 Favored 'General case' 0 C--N 1.315 -0.891 0 CA-C-O 121.059 0.457 . . . . 0.0 110.377 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 47.9 t -59.24 -51.83 67.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 C-N-CA 120.344 -0.542 . . . . 0.0 110.055 -179.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 95.6 mt -67.9 -27.68 66.85 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.976 0.417 . . . . 0.0 110.467 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 74.2 ttt180 -62.31 -42.43 99.36 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.408 -179.695 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 -60.56 -44.52 96.08 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 120.599 -0.441 . . . . 0.0 110.357 -179.672 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 10.2 mt -65.3 -39.01 91.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.318 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 99.4 60.05 0.87 Allowed Glycine 0 N--CA 1.462 0.403 0 N-CA-C 110.717 -0.953 . . . . 0.0 110.717 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 27.9 tp -118.53 -15.91 9.55 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 121.006 0.431 . . . . 0.0 110.352 -179.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 21.2 m -131.37 163.64 36.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.087 0.47 . . . . 0.0 110.281 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.487 ' CG1' ' N ' ' A' ' 78' ' ' GLY . 91.9 t -143.62 163.22 15.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.803 -179.481 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . 0.487 ' N ' ' CG1' ' A' ' 77' ' ' VAL . . . -108.56 161.24 13.35 Favored Glycine 0 CA--C 1.524 0.597 0 N-CA-C 110.584 -1.006 . . . . 0.0 110.584 179.606 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 . . . . . 0 C--N 1.328 -0.368 0 CA-C-O 120.761 0.315 . . . . 0.0 110.568 179.798 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 70.2 t . . . . . 0 N--CA 1.464 0.26 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 64.4 m-85 -90.93 124.6 35.33 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.387 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 65.5 m -138.67 158.79 43.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.516 -179.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 18.2 mt -66.88 140.47 57.79 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.315 -179.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.405 ' CD1' ' C ' ' A' ' 90' ' ' TYR . 14.5 t80 -57.12 -50.7 71.98 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.642 -179.76 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -100.98 134.27 44.22 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.879 0.371 . . . . 0.0 110.608 -179.486 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 70.8 p -74.26 -26.66 60.34 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.363 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 74.0 m80 -56.36 -43.69 79.38 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.338 -179.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 75.0 t -56.94 -43.06 79.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -179.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.37 -43.03 99.57 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.252 179.497 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 68.1 tp60 -64.34 -42.59 96.18 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.177 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 12.6 tp -59.02 -43.66 91.61 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.964 -179.373 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 90.4 mt -64.34 -39.71 94.44 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.191 179.444 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -58.92 -42.39 89.56 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.437 -179.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -66.16 -53.71 34.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.514 179.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.95 -41.06 86.54 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.021 0.438 . . . . 0.0 110.49 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 4.0 mm -61.63 -44.58 98.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.519 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' TYR . . . . . 0.508 ' O ' ' ND1' ' A' ' 107' ' ' HIS . 4.0 m-85 -66.21 -38.29 87.61 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.139 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 3.8 t60 -58.64 -42.81 89.19 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.589 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 29.8 t -79.45 -36.61 38.58 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.036 0.446 . . . . 0.0 111.22 179.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 48.1 tp10 -55.68 -40.77 72.76 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.433 -178.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . 0.508 ' ND1' ' O ' ' A' ' 103' ' ' TYR . 36.0 m80 . . . . . 0 N--CA 1.453 -0.292 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 -179.196 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 135' ' ' ASP . . . . . 0.503 ' O ' ' N ' ' B' ' 138' ' ' ALA . 94.4 m-20 . . . . . 0 C--O 1.232 0.161 0 CA-C-O 120.555 0.217 . . . . 0.0 110.624 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 69.3 p -38.35 -38.65 0.38 Allowed 'General case' 0 C--O 1.239 0.512 0 CA-C-O 121.285 0.564 . . . . 0.0 110.423 -179.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 137' ' ' GLN . . . . . 0.419 ' CG ' ' N ' ' B' ' 138' ' ' ALA . 23.5 pt20 -65.9 -45.18 82.93 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.398 179.174 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 138' ' ' ALA . . . . . 0.503 ' N ' ' O ' ' B' ' 135' ' ' ASP . . . -63.18 -28.16 69.86 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.163 179.708 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.28 -50.82 51.13 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.28 179.703 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -60.33 -46.32 90.3 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.534 179.724 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -54.39 -51.32 65.21 Favored 'General case' 0 C--O 1.241 0.646 0 CA-C-O 121.27 0.557 . . . . 0.0 110.544 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 142' ' ' VAL . . . . . . . . . . . . . 90.5 t -62.7 -45.88 97.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.451 179.686 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -52.05 -44.58 64.32 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 36.7 t -59.43 -44.44 92.9 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.039 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 8.1 m -63.68 -47.06 82.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.485 179.511 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 93.6 mt -66.53 -20.69 66.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.621 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 147' ' ' GLN . . . . . . . . . . . . . 58.8 tt0 -75.78 -56.85 4.29 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.585 179.287 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -57.93 -54.71 43.83 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.362 -179.424 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.483 ' O ' ' O ' ' B' ' 150' ' ' ALA . 94.2 mt -46.93 -41.7 16.49 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.359 -179.245 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 150' ' ' ALA . . . . . 0.519 ' O ' ' CB ' ' B' ' 151' ' ' THR . . . -50.6 -174.33 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.147 -0.479 . . . . 0.0 109.978 179.651 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 151' ' ' THR . . . . . 0.519 ' CB ' ' O ' ' B' ' 150' ' ' ALA . 1.0 OUTLIER 88.14 117.84 0.03 OUTLIER Pre-proline 0 CA--C 1.538 0.518 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 179.833 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -46.74 -46.47 18.03 Favored 'Trans proline' 0 N--CA 1.495 1.586 0 C-N-CA 122.322 2.015 . . . . 0.0 113.063 -178.518 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 48.1 t -58.97 -44.42 91.53 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.969 -179.253 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 20.7 mmt85 -61.78 -45.91 91.84 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.739 -0.385 . . . . 0.0 111.042 -179.463 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 155' ' ' LEU . . . . . 0.461 ' CD2' ' O ' ' B' ' 149' ' ' LEU . 4.2 mm? -62.76 -47.71 82.35 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 120.598 -0.441 . . . . 0.0 111.073 -179.853 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 156' ' ' MET . . . . . 0.44 ' C ' ' SD ' ' B' ' 156' ' ' MET . 14.4 tmm? -58.29 -49.24 77.84 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 120.337 -0.545 . . . . 0.0 110.612 -179.859 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 5.9 mm -64.4 -44.91 97.16 Favored 'Isoleucine or valine' 0 C--O 1.239 0.507 0 CA-C-O 121.098 0.475 . . . . 0.0 110.823 -179.504 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 57.7 mt -62.09 -41.77 98.53 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.599 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 159' ' ' THR . . . . . 0.421 ' OG1' ' O ' ' B' ' 155' ' ' LEU . 28.0 m -59.75 -41.9 92.02 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.179 -0.464 . . . . 0.0 109.815 179.292 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 160' ' ' GLN . . . . . 0.55 ' OE1' ' N ' ' B' ' 160' ' ' GLN . 0.0 OUTLIER -58.02 -49.24 77.55 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.854 -0.425 . . . . 0.0 109.854 179.958 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 161' ' ' LEU . . . . . . . . . . . . . 97.5 mt -63.95 -42.75 97.21 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 120.373 -0.531 . . . . 0.0 110.573 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 162' ' ' ARG . . . . . . . . . . . . . 72.5 ttp85 -71.3 -21.0 62.13 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.51 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 59.4 t-20 -63.18 -41.87 99.27 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.579 -179.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . 162.26 -165.44 36.01 Favored Glycine 0 CA--C 1.528 0.853 0 N-CA-C 111.017 -0.833 . . . . 0.0 111.017 -179.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -79.06 112.98 3.15 Favored 'Trans proline' 0 C--N 1.31 -1.486 0 C-N-CA 122.958 2.439 . . . . 0.0 111.769 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 166' ' ' LEU . . . . . 0.436 ' O ' ' O ' ' B' ' 167' ' ' PRO . 0.3 OUTLIER -153.35 85.86 4.11 Favored Pre-proline 0 C--N 1.325 -0.486 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.264 -178.935 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 167' ' ' PRO . . . . . 0.436 ' O ' ' O ' ' B' ' 166' ' ' LEU . 51.4 Cg_exo -50.69 -167.94 0.0 OUTLIER 'Trans proline' 0 C--N 1.306 -1.692 0 C-N-CA 122.607 2.205 . . . . 0.0 112.243 179.76 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . 80.0 t -59.59 -50.41 80.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.973 -179.209 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 169' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -57.54 -44.77 85.44 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.281 0.562 . . . . 0.0 109.976 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 -65.51 -34.69 78.85 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.632 179.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.62 -44.47 96.92 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 120.466 -0.493 . . . . 0.0 110.02 -179.614 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 172' ' ' ALA . . . . . . . . . . . . . . . -60.39 -44.33 95.78 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 179.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 45.3 tp10 -64.89 -30.65 71.66 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.388 179.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -69.92 -54.46 13.3 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.846 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 93.1 mt -93.56 -68.18 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.293 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . 133.46 96.75 0.6 Allowed Glycine 0 C--N 1.332 0.333 0 N-CA-C 111.317 -0.713 . . . . 0.0 111.317 -179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 61.6 mtt 61.91 96.68 0.03 OUTLIER 'General case' 0 CA--C 1.52 -0.19 0 CA-C-O 120.713 0.292 . . . . 0.0 110.765 178.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -178.93 19.02 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.58 179.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 56.0 mt-30 -54.23 -27.24 33.36 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.36 0.6 . . . . 0.0 110.848 -179.059 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 78.5 p -74.41 -32.71 62.77 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.394 179.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -73.29 -38.75 65.77 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.584 -178.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 7.3 p -73.42 -49.73 35.04 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.509 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.436 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 43.0 t -58.09 -43.77 87.26 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 120.706 -0.397 . . . . 0.0 110.129 -179.533 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 54.7 t-80 -67.16 -45.01 78.29 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.618 179.687 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -63.65 -49.76 71.97 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.708 -179.411 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -61.31 -44.27 97.48 Favored 'General case' 0 CA--C 1.502 -0.888 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.789 -179.532 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 60.5 ttp180 -59.62 -44.9 93.28 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.143 0.497 . . . . 0.0 110.469 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 44.2 t -58.93 -52.17 63.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.196 -179.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 86.1 mt -67.82 -28.38 67.52 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.938 0.399 . . . . 0.0 110.361 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 74.9 ttt180 -61.52 -42.34 98.67 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.412 -179.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -60.49 -45.36 94.04 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.71 -0.396 . . . . 0.0 110.437 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 192' ' ' LEU . . . . . . . . . . . . . 10.0 mt -65.03 -40.13 94.38 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.315 179.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 101.0 53.85 1.0 Allowed Glycine 0 N--CA 1.462 0.412 0 N-CA-C 111.005 -0.838 . . . . 0.0 111.005 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 14.9 tp -111.94 -15.06 13.4 Favored 'General case' 0 N--CA 1.462 0.125 0 CA-C-O 120.885 0.374 . . . . 0.0 110.618 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 23.9 m -132.13 163.76 36.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 121.015 0.436 . . . . 0.0 110.349 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 196' ' ' VAL . . . . . 0.486 ' CG1' ' N ' ' B' ' 197' ' ' GLY . 96.4 t -144.33 163.42 14.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.686 -179.6 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 197' ' ' GLY . . . . . 0.486 ' N ' ' CG1' ' B' ' 196' ' ' VAL . . . -109.21 160.04 13.74 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.534 -1.026 . . . . 0.0 110.534 179.598 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 . . . . . 0 C--N 1.327 -0.388 0 CA-C-O 120.738 0.304 . . . . 0.0 110.734 179.971 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 69.8 t . . . . . 0 N--CA 1.464 0.242 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 59.0 m-85 -91.8 125.12 36.39 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.512 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 67.8 m -139.26 158.53 43.99 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.502 -179.549 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . 15.9 mt -66.91 138.91 57.64 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.457 -179.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 15.2 t80 -54.77 -51.99 64.0 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.674 -179.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 63.8 m-20 -99.85 135.36 41.39 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.827 0.346 . . . . 0.0 110.673 -179.396 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 76.2 p -75.74 -24.26 56.09 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.374 179.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 212' ' ' HIS . . . . . . . . . . . . . 74.3 m80 -57.32 -43.48 83.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.289 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 74.5 t -57.67 -43.58 83.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 214' ' ' ALA . . . . . . . . . . . . . . . -59.7 -45.61 91.59 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.366 179.478 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 69.5 tp60 -63.63 -41.94 98.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.265 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 216' ' ' LEU . . . . . . . . . . . . . 14.6 tp -59.05 -43.93 91.73 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.025 -179.283 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 82.1 mt -64.51 -39.41 93.73 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.099 179.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -58.82 -42.3 88.89 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.514 -179.778 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 219' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -67.14 -51.43 54.04 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.534 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -59.77 -41.48 91.18 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.062 0.458 . . . . 0.0 110.406 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 4.4 mm -61.78 -44.04 98.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.674 -179.714 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 222' ' ' TYR . . . . . 0.432 ' O ' ' ND1' ' B' ' 226' ' ' HIS . 4.2 m-85 -66.36 -38.53 87.79 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.271 179.936 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 223' ' ' HIS . . . . . . . . . . . . . 3.3 t60 -58.48 -43.08 88.86 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.526 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 37.5 t -77.89 -36.27 49.81 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.9 179.494 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 37.0 tp10 -59.86 -30.94 69.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.529 -179.276 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 226' ' ' HIS . . . . . 0.432 ' ND1' ' O ' ' B' ' 222' ' ' TYR . 27.3 m80 . . . . . 0 CA--C 1.507 -0.704 0 CA-C-O 118.681 -0.676 . . . . 0.0 111.264 -179.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . 0.525 ' O ' ' N ' ' A' ' 19' ' ' ALA . 99.2 m-20 . . . . . 0 CA--C 1.523 -0.086 0 CA-C-O 120.416 0.15 . . . . 0.0 110.63 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.509 ' HG ' ' N ' ' A' ' 18' ' ' GLN . 86.4 p -38.46 -40.16 0.53 Allowed 'General case' 0 C--O 1.236 0.368 0 CA-C-O 121.239 0.542 . . . . 0.0 110.473 -179.788 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.509 ' N ' ' HG ' ' A' ' 17' ' ' SER . 94.8 mm-40 -65.49 -42.93 91.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.191 179.235 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.525 ' N ' ' O ' ' A' ' 16' ' ' ASP . . . -65.79 -28.77 69.26 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.501 179.407 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.61 -52.84 27.13 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.376 179.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.8 -49.58 76.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.914 0.387 . . . . 0.0 111.153 179.563 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 66.5 tp60 -53.62 -50.11 66.39 Favored 'General case' 0 C--O 1.242 0.682 0 CA-C-O 121.722 0.772 . . . . 0.0 109.996 -179.559 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 57.7 t -62.59 -41.76 93.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.639 -0.709 . . . . 0.0 109.689 179.517 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -50.68 -47.43 58.81 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.176 179.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 40.3 t -60.22 -43.84 95.67 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.318 -0.401 . . . . 0.0 109.982 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 24.2 m -63.24 -51.77 64.87 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.253 -0.579 . . . . 0.0 110.934 179.72 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 88.6 mt -67.76 -21.1 65.28 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.761 -179.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 52.7 tt0 -75.05 -60.56 2.24 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.759 179.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.455 ' O ' ' OG1' ' A' ' 32' ' ' THR . . . -58.33 -53.04 62.74 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.863 -179.063 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.432 ' O ' ' C ' ' A' ' 31' ' ' ALA . 4.0 mm? -51.23 -41.37 60.27 Favored 'General case' 0 CA--C 1.509 -0.634 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 -178.475 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.563 ' O ' ' C ' ' A' ' 32' ' ' THR . . . -39.22 -70.81 0.09 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.431 179.757 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.563 ' C ' ' O ' ' A' ' 31' ' ' ALA . 7.1 p -3.35 107.16 0.03 OUTLIER Pre-proline 0 N--CA 1.48 1.027 0 O-C-N 124.583 1.177 . . . . 0.0 111.018 -179.685 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -47.3 -48.47 15.0 Favored 'Trans proline' 0 C--N 1.307 -1.611 0 C-N-CA 122.073 1.849 . . . . 0.0 113.31 -177.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 11.1 t -57.62 -44.14 85.28 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.659 -179.297 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 38.5 ttm180 -61.18 -45.24 95.43 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 120.643 -0.423 . . . . 0.0 110.71 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 80.3 mt -57.69 -52.28 66.09 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.313 -0.555 . . . . 0.0 110.707 -179.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.439 ' O ' ' OG1' ' A' ' 40' ' ' THR . 53.9 ttp -53.63 -46.23 70.42 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.221 -0.592 . . . . 0.0 110.583 179.412 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 97.5 mt -62.36 -48.03 90.26 Favored 'Isoleucine or valine' 0 C--O 1.239 0.529 0 CA-C-O 121.332 0.587 . . . . 0.0 110.798 -179.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -61.89 -41.56 98.03 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.575 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.439 ' OG1' ' O ' ' A' ' 37' ' ' MET . 37.4 p -61.77 -33.98 75.06 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.988 179.956 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 60.8 tp60 -64.47 -50.49 67.27 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 120.603 -0.439 . . . . 0.0 109.897 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 16.6 mt -62.86 -30.45 71.52 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.495 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 10.8 ttm180 -42.58 -41.29 2.99 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.586 -179.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 95.1 m-20 -62.36 -42.92 99.78 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.981 0.42 . . . . 0.0 110.186 -179.747 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 162.23 178.32 36.01 Favored Glycine 0 CA--C 1.527 0.8 0 C-N-CA 120.559 -0.829 . . . . 0.0 111.361 179.027 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 15.1 Cg_exo -67.33 148.07 79.21 Favored 'Trans proline' 0 N--CA 1.49 1.28 0 C-N-CA 122.85 2.367 . . . . 0.0 111.899 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -164.43 159.4 15.86 Favored Pre-proline 0 CA--C 1.536 0.414 0 C-N-CA 120.262 -0.575 . . . . 0.0 110.793 178.734 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_exo -66.79 149.33 83.48 Favored 'Trans proline' 0 N--CA 1.496 1.629 0 C-N-CA 122.589 2.193 . . . . 0.0 112.292 178.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.421 ' CG2' ' N ' ' A' ' 50' ' ' THR . 5.0 m -64.57 -39.73 86.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.815 0.817 . . . . 0.0 110.695 179.193 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.421 ' N ' ' CG2' ' A' ' 49' ' ' VAL . 8.5 m -56.34 -66.08 0.5 Allowed 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 114.738 -1.119 . . . . 0.0 110.548 179.316 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -50.43 -39.24 46.97 Favored 'General case' 0 C--O 1.24 0.559 0 CA-C-O 121.441 0.639 . . . . 0.0 109.645 -179.204 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.4 tt -59.55 -42.17 91.77 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.859 -0.61 . . . . 0.0 109.433 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.533 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -65.0 -42.87 94.11 Favored 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 120.863 -0.335 . . . . 0.0 110.135 179.591 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 83.6 tt0 -53.62 -34.23 57.79 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 179.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -72.13 -38.87 69.17 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.582 178.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 96.8 mt -88.41 -68.95 0.62 Allowed 'Isoleucine or valine' 0 CA--C 1.521 -0.173 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.244 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . 0.533 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 148.94 71.25 0.01 OUTLIER Glycine 0 CA--C 1.521 0.451 0 N-CA-C 111.682 -0.567 . . . . 0.0 111.682 179.617 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 4.1 mmt 57.83 79.15 0.21 Allowed 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 120.779 0.323 . . . . 0.0 110.641 179.35 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 86.4 mt-10 -150.91 19.93 0.78 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.729 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -61.77 -30.64 70.93 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.411 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 36.0 t -65.26 -42.94 92.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.524 -179.8 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.53 -30.88 71.62 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.082 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 89.8 t -70.49 -49.91 49.39 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.209 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.566 179.436 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 38.8 t -57.06 -42.56 80.79 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 120.892 0.377 . . . . 0.0 110.249 -179.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 43.5 t60 -60.91 -50.6 72.76 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-O 121.259 0.552 . . . . 0.0 110.499 179.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 37.0 mt-30 -62.32 -34.54 76.82 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.069 179.646 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 2.4 tp -62.91 -43.68 98.14 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.223 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 95.5 mtt-85 -62.57 -41.56 99.0 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 120.849 0.356 . . . . 0.0 110.186 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 86.2 t -63.1 -53.84 41.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.199 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 12.5 mt -61.13 -40.85 95.35 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.027 0.441 . . . . 0.0 110.048 -179.485 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 62.2 ttm-85 -54.83 -41.01 70.16 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.941 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 -60.14 -48.18 82.81 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 120.396 -0.522 . . . . 0.0 110.495 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.4 mt -66.87 -41.47 87.21 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.936 0.398 . . . . 0.0 110.555 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 100.41 88.99 2.02 Favored Glycine 0 CA--C 1.52 0.389 0 N-CA-C 110.947 -0.861 . . . . 0.0 110.947 -179.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 5.1 tp -152.2 -14.17 0.18 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.749 0.309 . . . . 0.0 110.853 179.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.412 ' HA ' ' H ' ' A' ' 90' ' ' TYR . 28.1 m -134.96 158.64 41.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.066 -179.701 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.509 ' CG1' ' N ' ' A' ' 78' ' ' GLY . 59.4 t -124.07 170.98 13.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.276 -179.635 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . 0.509 ' N ' ' CG1' ' A' ' 77' ' ' VAL . . . -158.53 149.13 19.17 Favored Glycine 0 CA--C 1.526 0.733 0 N-CA-C 110.604 -0.998 . . . . 0.0 110.604 179.386 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 62.7 t0 . . . . . 0 N--CA 1.467 0.388 0 CA-C-O 120.905 0.383 . . . . 0.0 110.447 -179.911 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 52.2 t . . . . . 0 N--CA 1.465 0.303 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . 0.583 ' N ' ' CD1' ' A' ' 87' ' ' TYR . 0.2 OUTLIER -112.25 136.06 52.15 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.063 -179.815 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 1.9 m -150.92 171.66 16.9 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.805 -0.442 . . . . 0.0 109.805 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 34.0 mt -84.28 143.31 29.63 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.616 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.412 ' H ' ' HA ' ' A' ' 76' ' ' VAL . 77.5 t80 -60.42 -45.67 92.79 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.689 179.665 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.4 ' CB ' ' HD1' ' A' ' 93' ' ' HIS . 35.7 p30 -141.98 171.5 13.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.507 -179.893 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 54.9 p -96.83 -7.23 34.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.564 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . 0.606 ' CG ' ' CE1' ' B' ' 223' ' ' HIS . 61.4 m80 -41.85 -61.45 1.11 Allowed 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.033 0.444 . . . . 0.0 110.637 179.734 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 69.1 t -53.88 -41.04 47.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.788 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -56.84 -43.51 81.17 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.346 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 90.6 mt-30 -62.27 -45.4 93.46 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 121.153 0.502 . . . . 0.0 110.132 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 13.6 tp -56.84 -44.38 82.04 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.007 -179.332 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 92.9 mt -64.13 -37.12 86.3 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.01 179.546 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 46.3 t0 -56.47 -45.62 80.8 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.107 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.463 ' OE2' ' OE2' ' B' ' 219' ' ' GLU . 91.7 mt-10 -67.52 -52.09 43.16 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.604 179.382 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -52.74 -46.39 67.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.057 179.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 5.2 mm -63.39 -44.25 98.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 121.132 0.491 . . . . 0.0 110.71 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -60.65 -46.19 91.26 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.254 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' HIS . . . . . 0.61 ' CE1' ' CG ' ' B' ' 212' ' ' HIS . 68.2 t60 -65.29 -36.81 85.21 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.465 179.733 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 47.2 t -59.48 -46.59 88.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.333 -179.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 77.9 tt0 -74.7 -60.55 2.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.075 0.464 . . . . 0.0 110.807 179.333 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 85.6 t60 . . . . . 0 CA--C 1.515 -0.375 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.913 -179.574 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 135' ' ' ASP . . . . . 0.52 ' O ' ' N ' ' B' ' 138' ' ' ALA . 97.9 m-20 . . . . . 0 CA--C 1.523 -0.061 0 CA-C-O 120.474 0.178 . . . . 0.0 110.631 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 136' ' ' SER . . . . . 0.416 ' HG ' ' N ' ' B' ' 137' ' ' GLN . 92.8 p -38.43 -40.08 0.52 Allowed 'General case' 0 C--O 1.236 0.352 0 CA-C-O 121.27 0.557 . . . . 0.0 110.403 -179.71 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 137' ' ' GLN . . . . . 0.416 ' N ' ' HG ' ' B' ' 136' ' ' SER . 95.9 mm-40 -65.66 -43.27 89.91 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.172 179.175 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 138' ' ' ALA . . . . . 0.52 ' N ' ' O ' ' B' ' 135' ' ' ASP . . . -64.81 -29.1 70.05 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.489 179.44 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.83 -52.43 30.02 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.338 179.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -60.47 -50.14 74.76 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.929 0.395 . . . . 0.0 111.172 179.592 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 68.1 tp60 -53.92 -49.55 68.4 Favored 'General case' 0 C--O 1.243 0.72 0 CA-C-O 121.591 0.71 . . . . 0.0 110.019 -179.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 142' ' ' VAL . . . . . . . . . . . . . 53.4 t -62.21 -42.71 96.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.784 179.38 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -50.24 -46.76 55.07 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.011 179.648 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 11.3 t -59.99 -44.51 94.48 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.155 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 19.8 m -63.75 -51.36 65.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.265 0.555 . . . . 0.0 111.049 179.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 92.5 mt -67.75 -21.1 65.29 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.909 -179.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 147' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -75.34 -59.37 2.77 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.728 179.417 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 148' ' ' ALA . . . . . 0.47 ' O ' ' OG1' ' B' ' 151' ' ' THR . . . -59.02 -53.69 55.56 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.049 -179.159 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.441 ' O ' ' C ' ' B' ' 150' ' ' ALA . 4.0 mm? -50.86 -41.95 58.37 Favored 'General case' 0 CA--C 1.509 -0.599 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 -178.304 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 150' ' ' ALA . . . . . 0.553 ' O ' ' C ' ' B' ' 151' ' ' THR . . . -38.91 -72.18 0.07 Allowed 'General case' 0 CA--C 1.511 -0.555 0 O-C-N 123.519 0.512 . . . . 0.0 110.334 179.719 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 151' ' ' THR . . . . . 0.553 ' C ' ' O ' ' B' ' 150' ' ' ALA . 6.5 p -1.77 105.74 0.02 OUTLIER Pre-proline 0 N--CA 1.478 0.948 0 O-C-N 124.428 1.08 . . . . 0.0 111.088 -179.839 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo -46.32 -48.73 12.77 Favored 'Trans proline' 0 C--N 1.307 -1.648 0 C-N-CA 122.053 1.836 . . . . 0.0 113.154 -177.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 11.3 t -57.2 -43.99 83.22 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.722 -179.214 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 38.7 ttm180 -62.42 -43.86 97.82 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.592 -179.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 155' ' ' LEU . . . . . . . . . . . . . 31.5 mt -58.4 -51.5 69.57 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.424 -0.511 . . . . 0.0 110.718 -179.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 156' ' ' MET . . . . . 0.43 ' O ' ' OG1' ' B' ' 159' ' ' THR . 51.9 ttp -55.44 -45.65 76.81 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 120.267 -0.573 . . . . 0.0 110.596 179.727 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 97.0 mt -62.65 -47.4 93.08 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 CA-C-O 121.378 0.609 . . . . 0.0 110.87 -179.514 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -62.53 -41.31 98.79 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.602 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 159' ' ' THR . . . . . 0.43 ' OG1' ' O ' ' B' ' 156' ' ' MET . 31.3 p -62.47 -32.77 73.71 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.064 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 59.2 tp60 -64.93 -50.17 67.51 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.223 -0.444 . . . . 0.0 109.949 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 161' ' ' LEU . . . . . 0.429 ' O ' ' N ' ' B' ' 164' ' ' GLY . 17.0 mt -62.49 -31.75 72.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.584 179.776 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 162' ' ' ARG . . . . . . . . . . . . . 11.2 ttm180 -40.82 -41.47 1.58 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.618 -179.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -62.33 -42.25 99.23 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.316 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 164' ' ' GLY . . . . . 0.429 ' N ' ' O ' ' B' ' 161' ' ' LEU . . . 161.03 178.58 35.13 Favored Glycine 0 CA--C 1.527 0.785 0 C-N-CA 120.672 -0.775 . . . . 0.0 111.331 179.086 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_exo -67.74 147.94 76.44 Favored 'Trans proline' 0 N--CA 1.49 1.272 0 C-N-CA 122.836 2.357 . . . . 0.0 112.028 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -163.76 160.61 17.36 Favored Pre-proline 0 CA--C 1.534 0.359 0 C-N-CA 120.133 -0.627 . . . . 0.0 110.701 178.717 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 16.1 Cg_exo -68.22 149.33 75.98 Favored 'Trans proline' 0 N--CA 1.495 1.583 0 C-N-CA 122.525 2.15 . . . . 0.0 112.119 178.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 168' ' ' VAL . . . . . 0.426 ' CG2' ' N ' ' B' ' 169' ' ' THR . 4.5 m -64.54 -40.0 87.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 121.819 0.818 . . . . 0.0 110.728 179.143 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 169' ' ' THR . . . . . 0.426 ' N ' ' CG2' ' B' ' 168' ' ' VAL . 7.0 m -55.87 -66.5 0.41 Allowed 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 114.702 -1.135 . . . . 0.0 110.496 179.381 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 93.2 m-20 -50.35 -39.91 47.65 Favored 'General case' 0 C--O 1.239 0.546 0 CA-C-O 121.326 0.584 . . . . 0.0 109.687 -179.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 1.5 tt -58.99 -42.5 90.18 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.379 -0.601 . . . . 0.0 109.379 -179.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 172' ' ' ALA . . . . . 0.539 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -64.37 -42.63 96.08 Favored 'General case' 0 N--CA 1.446 -0.675 0 C-N-CA 120.826 -0.35 . . . . 0.0 110.18 179.575 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -53.92 -34.51 59.78 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.099 -0.5 . . . . 0.0 109.695 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -71.97 -38.22 69.77 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.574 178.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 96.7 mt -88.55 -69.43 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.519 -0.246 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.296 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 176' ' ' GLY . . . . . 0.539 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 148.98 70.43 0.01 OUTLIER Glycine 0 CA--C 1.522 0.5 0 N-CA-C 111.518 -0.633 . . . . 0.0 111.518 179.654 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 3.9 mmt 58.71 78.46 0.25 Allowed 'General case' 0 N--CA 1.462 0.148 0 CA-C-O 120.782 0.325 . . . . 0.0 110.807 179.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 86.3 mt-10 -150.55 20.15 0.82 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.8 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -61.69 -29.96 70.43 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.056 0.455 . . . . 0.0 110.29 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 6.9 t -65.57 -43.38 89.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.529 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -62.31 -30.81 71.41 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.177 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 83.9 t -71.0 -50.36 43.17 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.185 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.591 179.497 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 42.9 t -57.37 -41.74 80.74 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.928 0.394 . . . . 0.0 110.336 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 19.5 t60 -61.64 -51.0 70.27 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.212 0.53 . . . . 0.0 110.51 179.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 36.4 mt-30 -62.65 -32.81 73.92 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.015 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 2.7 tp -63.27 -44.12 96.02 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.1 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -62.63 -41.88 99.28 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 120.729 -0.388 . . . . 0.0 110.31 -179.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 98.1 t -62.58 -54.13 38.0 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 C-N-CA 119.974 -0.69 . . . . 0.0 110.351 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 12.6 mt -60.73 -40.35 92.01 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.08 0.466 . . . . 0.0 110.049 -179.479 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 62.7 ttm-85 -55.15 -41.68 72.12 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.025 -179.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 92.1 m-20 -59.69 -46.82 87.92 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.439 -0.504 . . . . 0.0 110.281 -179.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 192' ' ' LEU . . . . . . . . . . . . . 9.7 mt -67.11 -39.75 86.74 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.953 0.406 . . . . 0.0 110.417 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 97.54 88.79 1.88 Allowed Glycine 0 N--CA 1.463 0.474 0 N-CA-C 110.765 -0.934 . . . . 0.0 110.765 -179.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 4.7 tp -152.45 -13.64 0.17 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.802 0.334 . . . . 0.0 110.859 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 195' ' ' VAL . . . . . 0.411 ' HA ' ' H ' ' B' ' 209' ' ' TYR . 27.7 m -135.02 158.64 41.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 109.832 -0.432 . . . . 0.0 109.832 -179.697 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 196' ' ' VAL . . . . . 0.509 ' CG1' ' N ' ' B' ' 197' ' ' GLY . 64.7 t -121.8 169.02 13.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.323 -179.688 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 197' ' ' GLY . . . . . 0.509 ' N ' ' CG1' ' B' ' 196' ' ' VAL . . . -157.33 142.04 8.31 Favored Glycine 0 CA--C 1.525 0.665 0 N-CA-C 110.615 -0.994 . . . . 0.0 110.615 179.471 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 60.4 t0 . . . . . 0 N--CA 1.467 0.411 0 CA-C-O 120.935 0.398 . . . . 0.0 110.559 179.989 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 55.6 t . . . . . 0 N--CA 1.466 0.367 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 206' ' ' TYR . . . . . 0.593 ' N ' ' CD1' ' B' ' 206' ' ' TYR . 0.2 OUTLIER -108.43 135.9 48.94 Favored 'General case' 0 N--CA 1.469 0.485 0 O-C-N 123.58 0.55 . . . . 0.0 109.987 -179.834 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 207' ' ' SER . . . . . 0.42 ' HG ' ' C ' ' B' ' 206' ' ' TYR . 3.1 m -150.63 171.16 17.57 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 -179.834 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . 29.5 mt -83.77 143.13 30.19 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.623 -179.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 209' ' ' TYR . . . . . 0.411 ' H ' ' HA ' ' B' ' 195' ' ' VAL . 81.0 t80 -60.69 -46.02 91.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.71 179.77 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 43.2 p30 -140.84 172.56 12.52 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.338 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 43.5 p -98.37 -7.65 28.42 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.439 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 212' ' ' HIS . . . . . 0.61 ' CG ' ' CE1' ' A' ' 104' ' ' HIS . 60.5 m80 -41.7 -61.33 1.11 Allowed 'General case' 0 C--O 1.233 0.224 0 CA-C-O 120.96 0.41 . . . . 0.0 110.419 179.779 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 92.0 t -53.88 -41.64 49.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.181 -0.463 . . . . 0.0 109.771 -179.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 214' ' ' ALA . . . . . . . . . . . . . . . -56.44 -43.37 79.43 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.368 179.814 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 84.3 mt-30 -62.38 -45.26 93.97 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.072 -179.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 216' ' ' LEU . . . . . . . . . . . . . 12.6 tp -56.61 -44.38 81.1 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.509 -0.477 . . . . 0.0 109.898 -179.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 92.5 mt -63.8 -38.23 90.32 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.093 179.522 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 58.0 t0 -56.05 -45.84 79.09 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.08 -179.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 219' ' ' GLU . . . . . 0.463 ' OE2' ' OE2' ' A' ' 100' ' ' GLU . 93.6 mt-10 -67.66 -51.79 45.67 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.708 -0.397 . . . . 0.0 110.62 179.462 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -53.09 -46.32 68.59 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 179.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 4.8 mm -63.73 -44.08 98.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 121.084 0.469 . . . . 0.0 110.613 -179.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 84.5 t80 -60.58 -45.76 92.76 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.017 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 223' ' ' HIS . . . . . 0.606 ' CE1' ' CG ' ' A' ' 93' ' ' HIS . 68.5 t60 -65.55 -37.01 85.47 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.534 179.641 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 11.5 t -59.12 -46.73 87.58 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.339 -179.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -74.58 -59.8 2.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.09 0.472 . . . . 0.0 110.663 179.348 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 86.1 t60 . . . . . 0 CA--C 1.514 -0.435 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.877 -179.576 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 95.4 m-20 . . . . . 0 CA--C 1.528 0.111 0 CA-C-O 120.696 0.284 . . . . 0.0 110.737 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 12.4 t -45.02 -48.17 11.6 Favored 'General case' 0 C--O 1.239 0.549 0 CA-C-O 121.164 0.507 . . . . 0.0 110.142 179.488 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 9.4 mp0 -64.53 -45.53 86.75 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.125 -0.488 . . . . 0.0 109.895 179.461 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -56.14 -28.4 57.85 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.189 -0.46 . . . . 0.0 109.872 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -71.98 -49.54 36.4 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 110.108 -0.33 . . . . 0.0 110.108 179.429 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.03 -44.96 96.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.354 -179.803 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -60.96 -51.62 68.5 Favored 'General case' 0 C--O 1.242 0.671 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.701 -179.507 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.494 ' O ' ' OG1' ' A' ' 26' ' ' THR . 98.8 t -60.49 -44.28 96.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.967 179.744 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.69 -42.14 78.56 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 120.804 -0.358 . . . . 0.0 110.201 179.525 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.2 m -59.2 -43.86 92.23 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.309 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.494 ' OG1' ' O ' ' A' ' 23' ' ' VAL . 30.6 p -64.83 -52.24 57.78 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 120.833 -0.347 . . . . 0.0 110.635 179.872 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.414 ' N ' ' CD1' ' A' ' 27' ' ' LEU . 7.6 mp -63.17 -21.58 66.3 Favored 'General case' 0 C--O 1.223 -0.295 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.787 179.493 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -74.31 -59.91 2.51 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.688 179.391 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.62 -54.63 44.88 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.518 -179.478 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.505 ' O ' ' O ' ' A' ' 31' ' ' ALA . 8.5 mp -47.79 -32.42 5.99 Favored 'General case' 0 CA--C 1.515 -0.393 0 C-N-CA 120.956 -0.298 . . . . 0.0 110.387 -179.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.505 ' O ' ' O ' ' A' ' 30' ' ' LEU . . . -56.84 -139.04 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.459 0 O-C-N 123.51 0.506 . . . . 0.0 110.247 179.711 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.485 ' O ' ' O ' ' A' ' 31' ' ' ALA . 7.1 m 56.54 117.35 0.01 OUTLIER Pre-proline 0 C--N 1.32 -0.695 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.347 179.659 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -48.37 -47.83 18.89 Favored 'Trans proline' 0 C--N 1.308 -1.561 0 C-N-CA 122.311 2.008 . . . . 0.0 112.824 -178.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 77.8 p -58.15 -48.71 79.42 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.977 -178.467 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.1 mmp_? -68.15 -36.58 79.9 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.584 179.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.34 -53.45 56.55 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.468 -0.493 . . . . 0.0 110.687 -178.367 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.453 ' C ' ' SD ' ' A' ' 37' ' ' MET . 0.9 OUTLIER -60.73 -45.77 93.0 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.473 179.967 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 86.8 mt -61.18 -43.56 96.62 Favored 'Isoleucine or valine' 0 C--O 1.242 0.66 0 CA-C-O 121.258 0.552 . . . . 0.0 110.394 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 34.5 mt -62.06 -40.59 96.29 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.519 179.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 99.0 m -59.92 -42.25 93.53 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.912 179.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.451 ' NE2' ' SD ' ' A' ' 37' ' ' MET . 45.7 mt-30 -58.23 -44.12 88.08 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.132 179.715 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 19.4 mt -63.79 -42.92 97.65 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.897 178.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.507 HH12 ' C ' ' A' ' 98' ' ' LEU . 59.0 ttp180 -62.69 -35.88 81.12 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.323 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 14.3 t-20 -57.82 -41.42 82.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.607 -178.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 163.36 -175.96 39.58 Favored Glycine 0 CA--C 1.526 0.762 0 N-CA-C 110.972 -0.851 . . . . 0.0 110.972 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -74.58 135.03 19.35 Favored 'Trans proline' 0 N--CA 1.495 1.603 0 C-N-CA 122.812 2.341 . . . . 0.0 112.075 -179.533 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -157.02 98.82 2.01 Favored Pre-proline 0 CA--C 1.54 0.585 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.265 -178.833 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_exo -47.12 165.05 0.1 Allowed 'Trans proline' 0 C--N 1.301 -1.934 0 C-N-CA 122.321 2.014 . . . . 0.0 112.554 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 75.1 t -48.6 -43.48 13.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.693 -179.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 47.3 p -61.25 -39.86 91.91 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.504 179.569 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -64.71 -38.2 90.2 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.003 179.769 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.5 -46.84 86.62 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 120.42 -0.512 . . . . 0.0 110.223 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.525 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -55.18 -47.2 75.56 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.657 179.558 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 48.9 tp10 -55.38 -50.41 69.78 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.168 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.08 -58.22 7.21 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.767 -179.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 98.4 mt -85.7 -73.69 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.444 179.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . 0.525 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 131.62 94.51 0.63 Allowed Glycine 0 N--CA 1.461 0.358 0 N-CA-C 111.163 -0.775 . . . . 0.0 111.163 179.695 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 84.6 mmm 67.54 84.27 0.16 Allowed 'General case' 0 CA--C 1.521 -0.161 0 CA-C-O 120.829 0.347 . . . . 0.0 111.025 178.593 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 15.2 tt0 -169.32 28.15 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.275 179.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -66.45 -23.83 66.34 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.78 -179.335 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 15.5 t -66.06 -44.46 84.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.132 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.531 ' O ' ' NE2' ' A' ' 66' ' ' GLN . . . -63.4 -31.98 73.28 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.327 -179.695 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 60.2 t -72.6 -53.81 18.04 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.242 0 C-N-CA 120.746 -0.382 . . . . 0.0 110.647 -179.457 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 79.7 p -58.13 -40.3 80.94 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.909 -0.317 . . . . 0.0 110.165 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' HIS . . . . . 0.41 ' ND1' ' OE1' ' A' ' 66' ' ' GLN . 50.4 t-80 -65.86 -51.21 60.74 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.087 0.47 . . . . 0.0 110.845 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . 0.531 ' NE2' ' O ' ' A' ' 62' ' ' ALA . 0.7 OUTLIER -61.9 -39.55 92.35 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.287 179.765 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 23.6 tp -61.8 -44.3 97.14 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.236 -179.49 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 21.0 mmt85 -61.67 -41.64 97.83 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 120.795 0.331 . . . . 0.0 110.516 -179.376 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 94.0 t -61.2 -55.01 27.48 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.222 0 C-N-CA 120.224 -0.59 . . . . 0.0 110.262 -179.522 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 10.5 mp -62.0 -39.57 92.68 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 179.392 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 78.1 ttt-85 -51.96 -42.67 63.07 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.003 -179.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -60.63 -45.57 93.54 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.638 -0.425 . . . . 0.0 110.25 179.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.8 mt -65.84 -38.71 89.59 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.134 179.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 91.33 32.75 8.53 Favored Glycine 0 CA--C 1.522 0.522 0 N-CA-C 110.905 -0.878 . . . . 0.0 110.905 -179.534 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 91.2 mt -95.85 -1.33 49.71 Favored 'General case' 0 CA--C 1.519 -0.232 0 O-C-N 122.86 -0.2 . . . . 0.0 110.597 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 26.8 m -134.28 155.97 39.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.191 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 73.0 t -124.95 137.61 56.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.146 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -119.89 129.87 8.17 Favored Glycine 0 N--CA 1.465 0.589 0 N-CA-C 110.734 -0.946 . . . . 0.0 110.734 179.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 12.9 t70 . . . . . 0 N--CA 1.465 0.319 0 N-CA-C 110.304 -0.258 . . . . 0.0 110.304 -179.8 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 99.5 t . . . . . 0 N--CA 1.463 0.217 0 CA-C-O 120.956 0.407 . . . . 0.0 110.577 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 65.4 m-85 -98.62 125.2 43.81 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.133 179.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 86.7 p -142.24 160.62 39.89 Favored 'General case' 0 C--O 1.224 -0.271 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.438 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 7.3 mt -72.73 136.69 45.57 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.633 -179.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.468 ' CD1' ' C ' ' A' ' 90' ' ' TYR . 20.8 t80 -62.59 -51.52 67.0 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.743 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.5 m-20 -83.58 143.06 30.4 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.526 -179.409 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 98.9 m -94.21 -25.82 16.92 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.357 179.091 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . 0.62 ' CG ' ' ND1' ' B' ' 223' ' ' HIS . 77.9 m-70 -58.23 -44.04 88.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.363 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.403 ' CG2' ' N ' ' A' ' 95' ' ' ALA . 20.0 m -56.04 -42.01 70.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.021 -179.862 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . 0.403 ' N ' ' CG2' ' A' ' 94' ' ' VAL . . . -60.88 -45.97 92.46 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.997 0.427 . . . . 0.0 110.28 179.035 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 67.1 tp60 -62.04 -41.52 98.21 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.106 179.34 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 11.3 tp -58.56 -44.4 89.7 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.22 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.507 ' C ' HH12 ' A' ' 43' ' ' ARG . 87.1 mt -63.24 -39.54 94.91 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.227 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . 0.494 ' N ' ' NH1' ' A' ' 43' ' ' ARG . 52.1 m-20 -59.36 -41.24 88.82 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.747 0.308 . . . . 0.0 110.527 -179.481 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -69.53 -54.41 14.28 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.993 179.456 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.12 -43.23 91.94 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.443 -179.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . 0.401 ' CG1' ' O ' ' A' ' 98' ' ' LEU . 4.1 mm -61.68 -45.54 98.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.328 -179.283 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 87.7 t80 -60.2 -39.7 87.47 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.865 0.365 . . . . 0.0 110.275 179.594 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' HIS . . . . . 0.574 ' ND1' ' CG ' ' B' ' 212' ' ' HIS . 57.6 t60 -63.76 -39.34 94.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.747 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 29.8 t -75.7 -42.8 49.91 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.895 179.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 11.6 tm-20 -60.08 -37.86 81.17 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.495 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 82.2 t60 . . . . . 0 CA--C 1.508 -0.647 0 CA-C-N 116.114 -0.493 . . . . 0.0 109.887 -179.048 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 94.3 m-20 . . . . . 0 N--CA 1.462 0.172 0 CA-C-O 120.797 0.332 . . . . 0.0 110.646 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 44.1 t -44.32 -49.31 9.53 Favored 'General case' 0 C--O 1.241 0.622 0 CA-C-O 121.088 0.47 . . . . 0.0 110.356 179.265 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 9.5 mp0 -64.19 -45.29 88.99 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.058 179.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 138' ' ' ALA . . . . . . . . . . . . . . . -56.3 -28.65 59.49 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.189 -0.459 . . . . 0.0 109.872 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -71.66 -49.93 35.24 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 179.569 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -60.74 -45.48 94.12 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.338 -179.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -60.44 -51.56 68.94 Favored 'General case' 0 C--O 1.24 0.583 0 CA-C-O 121.134 0.492 . . . . 0.0 110.652 -179.361 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 142' ' ' VAL . . . . . 0.48 ' O ' ' OG1' ' B' ' 145' ' ' THR . 95.1 t -60.42 -44.24 95.76 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.308 0 CA-C-N 115.888 -0.597 . . . . 0.0 109.993 179.786 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -56.86 -42.13 79.19 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.733 0.301 . . . . 0.0 110.274 179.69 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 70.4 m -59.08 -44.38 91.88 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.377 -179.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 145' ' ' THR . . . . . 0.48 ' OG1' ' O ' ' B' ' 142' ' ' VAL . 35.4 p -64.33 -51.37 63.73 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.702 179.753 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 146' ' ' LEU . . . . . 0.403 ' N ' ' CD1' ' B' ' 146' ' ' LEU . 7.6 mp -63.68 -21.51 66.42 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.805 179.502 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 147' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -74.68 -59.59 2.66 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.709 179.418 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -58.33 -54.77 43.2 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.685 -179.476 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.478 ' O ' ' O ' ' B' ' 150' ' ' ALA . 8.7 mp -48.42 -30.57 5.19 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.914 -0.314 . . . . 0.0 110.392 -179.891 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 150' ' ' ALA . . . . . 0.482 ' O ' ' O ' ' B' ' 151' ' ' THR . . . -58.08 -138.33 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.456 0 O-C-N 123.611 0.569 . . . . 0.0 110.144 179.702 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 151' ' ' THR . . . . . 0.482 ' O ' ' O ' ' B' ' 150' ' ' ALA . 27.2 m 56.1 117.37 0.01 OUTLIER Pre-proline 0 C--N 1.323 -0.557 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.438 179.636 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -48.25 -47.83 18.61 Favored 'Trans proline' 0 C--N 1.307 -1.624 0 C-N-CA 122.281 1.988 . . . . 0.0 112.901 -179.115 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 77.4 p -58.18 -48.92 78.81 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.933 -178.435 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 1.1 mmp_? -67.39 -37.04 82.51 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.598 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 155' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.24 -53.19 60.63 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.399 -0.52 . . . . 0.0 110.714 -178.347 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 156' ' ' MET . . . . . 0.457 ' C ' ' SD ' ' B' ' 156' ' ' MET . 1.0 OUTLIER -61.15 -45.65 93.77 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.452 179.981 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 92.6 mt -60.93 -43.75 96.51 Favored 'Isoleucine or valine' 0 C--O 1.242 0.667 0 CA-C-O 121.227 0.537 . . . . 0.0 110.434 -179.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 17.0 mt -62.29 -40.13 95.27 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.395 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 19.7 m -59.87 -43.2 94.84 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.158 179.551 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 160' ' ' GLN . . . . . 0.446 ' NE2' ' SD ' ' B' ' 156' ' ' MET . 45.0 mt-30 -57.9 -44.25 86.64 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.077 179.72 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 161' ' ' LEU . . . . . . . . . . . . . 20.0 mt -63.95 -42.89 97.17 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.915 179.02 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 162' ' ' ARG . . . . . 0.519 HH12 ' C ' ' B' ' 217' ' ' LEU . 58.7 ttp180 -62.9 -35.45 80.09 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.253 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 17.1 t-20 -58.19 -44.61 88.16 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.747 -178.649 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . 167.46 -174.86 42.6 Favored Glycine 0 CA--C 1.526 0.777 0 N-CA-C 110.989 -0.844 . . . . 0.0 110.989 179.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -75.51 133.23 15.61 Favored 'Trans proline' 0 N--CA 1.494 1.543 0 C-N-CA 122.839 2.359 . . . . 0.0 111.997 -179.728 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -155.41 99.08 2.3 Favored Pre-proline 0 CA--C 1.539 0.555 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.275 -178.882 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_exo -47.56 165.28 0.12 Allowed 'Trans proline' 0 C--N 1.3 -2.015 0 C-N-CA 122.45 2.1 . . . . 0.0 112.411 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . 87.5 t -48.75 -43.4 14.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.68 -179.683 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 169' ' ' THR . . . . . . . . . . . . . 63.4 p -61.45 -39.52 91.14 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.446 179.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.83 -38.63 91.64 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.151 179.516 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.29 -46.56 88.21 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 120.309 -0.556 . . . . 0.0 110.149 179.771 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 172' ' ' ALA . . . . . 0.55 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -55.45 -47.18 76.46 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 179.435 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 43.8 tp10 -55.43 -50.56 69.48 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.424 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -52.0 -57.22 10.12 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 120.81 -0.356 . . . . 0.0 110.774 -179.592 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 99.1 mt -87.1 -70.99 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.522 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 176' ' ' GLY . . . . . 0.55 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 128.14 94.36 0.81 Allowed Glycine 0 N--CA 1.461 0.357 0 N-CA-C 111.136 -0.786 . . . . 0.0 111.136 179.696 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 83.8 mmm 68.96 86.46 0.13 Allowed 'General case' 0 C--N 1.34 0.189 0 C-N-CA 120.899 -0.32 . . . . 0.0 110.981 178.388 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 47.3 tt0 -172.53 28.01 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.193 179.306 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 72.5 mt-30 -66.75 -23.8 66.13 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.762 -179.531 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 11.9 t -66.53 -44.12 83.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.028 -179.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 181' ' ' ALA . . . . . 0.522 ' O ' ' NE2' ' B' ' 185' ' ' GLN . . . -63.7 -32.39 73.86 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.482 -179.765 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 65.0 t -71.94 -53.56 19.73 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 C-N-CA 120.664 -0.414 . . . . 0.0 110.655 -179.314 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 77.5 p -58.36 -39.92 80.85 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.91 -0.316 . . . . 0.0 110.247 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 184' ' ' HIS . . . . . 0.4 ' ND1' ' OE1' ' B' ' 185' ' ' GLN . 49.6 t-80 -65.68 -51.11 62.0 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.714 179.897 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 185' ' ' GLN . . . . . 0.522 ' NE2' ' O ' ' B' ' 181' ' ' ALA . 0.8 OUTLIER -62.23 -40.62 96.73 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.36 179.835 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 17.5 tp -60.67 -44.61 96.28 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.105 -179.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 21.5 mmt85 -60.99 -41.84 97.26 Favored 'General case' 0 C--O 1.24 0.563 0 CA-C-O 120.81 0.338 . . . . 0.0 110.546 -179.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 87.9 t -61.14 -54.93 28.51 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.177 0 C-N-CA 120.25 -0.58 . . . . 0.0 110.19 -179.517 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 10.5 mp -62.0 -39.68 93.08 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 110.152 -0.314 . . . . 0.0 110.152 179.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 77.1 ttt-85 -51.48 -42.9 61.96 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.03 -179.488 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 55.4 t30 -60.57 -45.57 93.43 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.461 179.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 192' ' ' LEU . . . . . . . . . . . . . 10.1 mt -65.26 -39.36 92.53 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.196 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 91.6 33.2 8.09 Favored Glycine 0 CA--C 1.524 0.61 0 N-CA-C 110.821 -0.912 . . . . 0.0 110.821 -179.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 77.8 mt -97.33 -0.74 45.94 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.513 0.197 . . . . 0.0 110.632 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 24.9 m -134.26 155.58 39.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.263 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 196' ' ' VAL . . . . . . . . . . . . . 76.1 t -125.57 138.98 52.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.128 -179.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 197' ' ' GLY . . . . . . . . . . . . . . . -121.65 130.66 8.19 Favored Glycine 0 N--CA 1.464 0.548 0 N-CA-C 110.823 -0.911 . . . . 0.0 110.823 179.697 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 13.1 t70 . . . . . 0 N--CA 1.465 0.287 0 N-CA-C 110.305 -0.257 . . . . 0.0 110.305 -179.813 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 89.5 t . . . . . 0 N--CA 1.462 0.17 0 CA-C-O 120.898 0.38 . . . . 0.0 110.609 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 68.6 m-85 -98.18 125.36 43.19 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.309 179.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 34.2 p -142.68 160.69 39.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.335 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . 6.0 mt -73.17 138.07 45.47 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.751 -179.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 209' ' ' TYR . . . . . 0.461 ' C ' ' CD1' ' B' ' 209' ' ' TYR . 22.3 t80 -63.46 -52.39 61.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.801 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 43.1 m-20 -82.7 142.5 31.61 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.474 -179.339 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 99.3 m -94.6 -24.06 17.37 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-O 121.068 0.461 . . . . 0.0 110.33 179.223 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 212' ' ' HIS . . . . . 0.574 ' CG ' ' ND1' ' A' ' 104' ' ' HIS . 85.6 m-70 -59.5 -43.79 93.27 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.211 179.755 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 213' ' ' VAL . . . . . 0.429 ' CG2' ' N ' ' B' ' 214' ' ' ALA . 15.5 m -56.1 -42.77 73.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.021 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 214' ' ' ALA . . . . . 0.429 ' N ' ' CG2' ' B' ' 213' ' ' VAL . . . -59.9 -46.41 89.44 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.188 179.013 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 68.4 tp60 -61.36 -41.15 96.6 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.019 179.497 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 216' ' ' LEU . . . . . . . . . . . . . 10.0 tp -59.04 -43.99 91.71 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.268 -179.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 217' ' ' LEU . . . . . 0.519 ' C ' HH12 ' B' ' 162' ' ' ARG . 91.3 mt -63.51 -38.96 93.14 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.229 179.709 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 218' ' ' ASP . . . . . 0.478 ' N ' ' NH1' ' B' ' 162' ' ' ARG . 69.3 m-20 -59.66 -41.55 90.84 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.889 0.376 . . . . 0.0 110.603 -179.52 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 219' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -69.52 -54.92 11.81 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.984 179.581 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -58.15 -43.76 87.55 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.4 -179.686 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 221' ' ' ILE . . . . . 0.414 ' CG1' ' O ' ' B' ' 217' ' ' LEU . 4.1 mm -61.47 -45.91 97.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.388 -178.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 86.5 t80 -60.94 -40.14 92.13 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.244 179.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 223' ' ' HIS . . . . . 0.62 ' ND1' ' CG ' ' A' ' 93' ' ' HIS . 41.4 t60 -61.5 -41.92 98.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.032 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 35.6 t -73.63 -40.79 63.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.013 179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 11.4 tm-20 -65.29 -31.38 72.49 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.708 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 226' ' ' HIS . . . . . 0.524 ' O ' ' CD2' ' B' ' 226' ' ' HIS . 76.2 t60 . . . . . 0 C--N 1.325 -0.457 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.689 -179.52 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 93.7 m-20 . . . . . 0 C--O 1.224 -0.267 0 CA-C-O 120.46 0.171 . . . . 0.0 110.7 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 47.6 t -38.74 -49.91 1.62 Allowed 'General case' 0 C--O 1.239 0.518 0 CA-C-O 121.383 0.611 . . . . 0.0 110.606 -179.661 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -64.64 -46.43 82.57 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.003 179.319 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -58.43 -28.65 65.46 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.221 -179.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -70.97 -51.0 28.23 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 120.888 0.375 . . . . 0.0 110.128 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.49 -40.53 96.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.557 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 5.4 tm0? -62.31 -50.43 71.67 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-O 121.417 0.627 . . . . 0.0 110.444 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.478 ' O ' ' OG1' ' A' ' 26' ' ' THR . 93.9 t -61.74 -43.36 97.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.98 179.712 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.71 -41.4 81.67 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 58.9 m -59.47 -45.25 92.16 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.154 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.478 ' OG1' ' O ' ' A' ' 23' ' ' VAL . 22.6 p -63.99 -44.58 92.26 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-O 120.937 0.398 . . . . 0.0 110.442 179.551 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 95.9 mt -67.13 -21.73 65.83 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.332 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 60.1 tt0 -74.49 -58.18 3.45 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.274 179.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.98 -55.19 31.9 Favored 'General case' 0 CA--C 1.52 -0.205 0 C-N-CA 120.511 -0.476 . . . . 0.0 110.276 -179.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.487 ' O ' ' O ' ' A' ' 31' ' ' ALA . 50.3 tp -43.94 -32.34 1.1 Allowed 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 110.12 -0.326 . . . . 0.0 110.12 -178.524 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.487 ' O ' ' O ' ' A' ' 30' ' ' LEU . . . -58.24 -136.2 0.0 OUTLIER 'General case' 0 C--O 1.218 -0.6 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.84 178.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.453 ' O ' ' O ' ' A' ' 31' ' ' ALA . 9.4 m 55.12 113.15 0.02 OUTLIER Pre-proline 0 CA--C 1.538 0.488 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.836 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_exo -47.84 -45.77 23.45 Favored 'Trans proline' 0 C--N 1.309 -1.505 0 C-N-CA 122.395 2.064 . . . . 0.0 113.247 -179.211 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 51.7 m -54.14 -42.89 70.04 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.132 0.492 . . . . 0.0 111.188 -179.338 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.5 mmp_? -68.39 -34.42 76.01 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.066 179.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -64.55 -56.23 15.39 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.431 -0.508 . . . . 0.0 111.84 -179.025 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.498 ' O ' ' OG1' ' A' ' 40' ' ' THR . 3.3 ptm -58.26 -44.06 88.19 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.092 0.473 . . . . 0.0 110.037 179.752 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 92.4 mt -64.02 -43.9 97.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 121.492 0.663 . . . . 0.0 110.144 179.11 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 64.0 tp -59.51 -41.17 89.31 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.927 -179.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.498 ' OG1' ' O ' ' A' ' 37' ' ' MET . 41.4 p -63.93 -35.78 81.78 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.309 -179.754 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 89.8 mm-40 -63.61 -50.81 67.93 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 120.501 -0.48 . . . . 0.0 110.245 179.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 78.9 mt -63.44 -32.86 74.42 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.666 179.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 61.5 ttp180 -53.16 -39.49 63.61 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.197 -179.44 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 43.0 t-20 -61.92 -41.1 97.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.815 0.34 . . . . 0.0 110.593 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 168.5 177.62 39.64 Favored Glycine 0 CA--C 1.527 0.785 0 N-CA-C 111.016 -0.833 . . . . 0.0 111.016 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_endo -69.43 152.38 71.03 Favored 'Trans proline' 0 C--N 1.309 -1.503 0 C-N-CA 122.893 2.395 . . . . 0.0 111.897 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 1.3 pp 178.59 148.28 0.39 Allowed Pre-proline 0 N--CA 1.451 -0.418 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.789 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -72.63 -175.66 1.94 Allowed 'Trans proline' 0 N--CA 1.494 1.547 0 C-N-CA 122.756 2.304 . . . . 0.0 112.208 178.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.695 ' O ' ' N ' ' A' ' 52' ' ' LEU . 33.1 m -75.79 -61.42 1.7 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.582 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.912 179.471 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.673 ' H ' ' CG2' ' A' ' 49' ' ' VAL . 71.8 p -29.32 -46.1 0.05 Allowed 'General case' 0 N--CA 1.475 0.801 0 CA-C-O 121.464 0.649 . . . . 0.0 110.362 -179.449 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -62.33 -43.55 98.55 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.099 178.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.695 ' N ' ' O ' ' A' ' 49' ' ' VAL . 0.2 OUTLIER -61.33 -38.62 87.57 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.846 -179.754 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.533 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -61.53 -43.85 98.12 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.635 -0.505 . . . . 0.0 109.635 179.712 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -57.0 -46.48 82.24 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 179.628 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.28 -49.46 77.74 Favored 'General case' 0 C--O 1.231 0.094 0 C-N-CA 120.73 -0.388 . . . . 0.0 110.248 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 96.3 mt -92.7 -79.22 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.346 179.502 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . 0.533 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 141.76 89.73 0.14 Allowed Glycine 0 CA--C 1.519 0.331 0 N-CA-C 111.171 -0.772 . . . . 0.0 111.171 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 32.0 ttp 69.23 105.94 0.06 Allowed 'General case' 0 CA--C 1.52 -0.21 0 CA-C-O 120.53 0.205 . . . . 0.0 110.682 179.261 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 176.05 10.98 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.528 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -53.8 -37.56 63.64 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.705 -179.293 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 4.8 t -61.45 -48.94 78.83 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.951 -179.548 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.4 -35.68 68.05 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.224 -179.748 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 90.2 t -69.42 -52.96 27.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 C-N-CA 120.524 -0.47 . . . . 0.0 110.778 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.487 ' HG ' ' N ' ' A' ' 65' ' ' HIS . 78.3 p -56.32 -43.32 78.88 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.876 0.369 . . . . 0.0 110.53 -179.79 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' HIS . . . . . 0.487 ' N ' ' HG ' ' A' ' 64' ' ' SER . 55.9 t-80 -63.76 -51.07 66.51 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.019 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -61.04 -38.4 86.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.417 179.708 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 54.4 tp -60.84 -45.35 94.83 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.428 -179.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 74.1 ttt180 -60.77 -45.37 94.62 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-O 121.091 0.472 . . . . 0.0 110.509 -179.521 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 91.4 t -65.54 -54.5 27.53 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.386 0 C-N-CA 120.203 -0.599 . . . . 0.0 110.583 -179.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 97.7 mt -56.37 -40.73 75.04 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 -179.435 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 59.1 ttt85 -57.83 -39.64 78.15 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.26 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 97.6 m-20 -62.24 -43.54 98.59 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 120.548 -0.461 . . . . 0.0 110.594 -179.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 7.0 mt -65.9 -44.72 84.4 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-O 120.953 0.406 . . . . 0.0 110.587 -179.29 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 104.15 96.56 2.41 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 111.612 -0.595 . . . . 0.0 111.612 179.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -171.92 -6.11 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.898 0.38 . . . . 0.0 110.654 179.205 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 30.8 m -138.83 157.62 29.52 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.19 179.656 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 61.2 t -143.82 155.59 15.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.432 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -126.41 144.89 15.4 Favored Glycine 0 N--CA 1.462 0.429 0 N-CA-C 110.446 -1.062 . . . . 0.0 110.446 179.378 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 . . . . . 0 N--CA 1.466 0.328 0 N-CA-C 110.349 -0.241 . . . . 0.0 110.349 -179.996 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 20.1 m . . . . . 0 N--CA 1.463 0.209 0 N-CA-C 110.355 -0.239 . . . . 0.0 110.355 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 27.7 m-85 -115.75 136.58 52.91 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.463 -179.66 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 20.1 m -151.07 171.95 16.51 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.193 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.521 ' N ' ' CD1' ' A' ' 89' ' ' LEU . 8.3 mp -74.8 146.64 41.89 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.494 -179.91 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 58.6 t80 -52.18 -47.52 65.5 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.493 179.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.576 ' CG ' ' H ' ' A' ' 92' ' ' THR . 43.4 t0 -155.4 -177.42 6.54 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.387 -179.799 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' THR . . . . . 0.576 ' H ' ' CG ' ' A' ' 91' ' ' ASP . 5.5 t -77.48 6.84 6.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.451 -179.808 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . 0.552 ' CG ' ' CE1' ' B' ' 223' ' ' HIS . 34.9 m80 -62.27 -73.39 0.11 Allowed 'General case' 0 C--O 1.236 0.345 0 CA-C-O 120.976 0.417 . . . . 0.0 110.308 179.889 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 82.4 t -45.22 -40.19 2.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.29 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.46 -39.61 93.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.524 179.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 8.8 tp-100 -60.54 -47.43 86.2 Favored 'General case' 0 C--O 1.241 0.632 0 CA-C-O 121.095 0.474 . . . . 0.0 110.176 -179.412 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.515 ' N ' ' CD1' ' A' ' 97' ' ' LEU . 7.2 mp -62.86 -43.28 99.22 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.263 -179.626 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 7.0 tp -63.58 -39.7 95.07 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.029 179.828 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 47.4 t0 -56.48 -47.63 78.82 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.169 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.531 ' N ' ' OE1' ' A' ' 100' ' ' GLU . 0.3 OUTLIER -63.33 -51.56 65.45 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 120.639 -0.425 . . . . 0.0 110.279 179.678 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -56.48 -43.01 79.23 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.575 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 4.1 mm -61.45 -45.6 98.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 C-N-CA 120.512 -0.475 . . . . 0.0 110.502 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 85.1 t80 -61.85 -45.02 95.62 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.981 0.42 . . . . 0.0 110.449 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' HIS . . . . . 0.534 ' CE1' ' CG ' ' B' ' 212' ' ' HIS . 13.9 t60 -55.43 -45.24 76.78 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.601 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 35.3 t -76.07 -33.64 59.56 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.859 179.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 78.7 tt0 -58.88 -38.93 79.94 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.378 -179.471 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 7.6 t60 . . . . . 0 CA--C 1.521 -0.168 0 C-N-CA 120.503 -0.479 . . . . 0.0 110.159 -179.289 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 97.0 m-20 . . . . . 0 C--O 1.224 -0.28 0 CA-C-O 120.505 0.193 . . . . 0.0 110.746 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 27.3 t -39.32 -49.89 1.99 Allowed 'General case' 0 C--O 1.238 0.49 0 CA-C-O 121.439 0.637 . . . . 0.0 110.479 -179.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -64.23 -45.99 85.8 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.902 179.352 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 138' ' ' ALA . . . . . . . . . . . . . . . -58.74 -28.27 65.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.419 -179.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -71.39 -50.74 29.02 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-O 120.85 0.357 . . . . 0.0 110.168 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -62.78 -40.95 98.91 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.522 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 4.7 tm0? -61.68 -51.19 69.46 Favored 'General case' 0 C--O 1.24 0.586 0 CA-C-O 121.395 0.617 . . . . 0.0 110.457 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 142' ' ' VAL . . . . . 0.478 ' O ' ' OG1' ' B' ' 145' ' ' THR . 85.8 t -61.32 -44.33 98.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.013 179.844 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -56.38 -41.34 76.07 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 62.1 m -59.32 -45.36 91.53 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.178 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 145' ' ' THR . . . . . 0.478 ' OG1' ' O ' ' B' ' 142' ' ' VAL . 46.9 p -64.0 -44.87 91.34 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.311 179.434 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 96.0 mt -66.4 -22.41 66.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.425 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 147' ' ' GLN . . . . . . . . . . . . . 59.5 tt0 -74.12 -59.08 2.89 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.29 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -60.78 -55.01 38.18 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 120.571 -0.452 . . . . 0.0 110.308 -179.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.475 ' O ' ' O ' ' B' ' 150' ' ' ALA . 47.8 tp -44.31 -31.3 0.99 Allowed 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 120.914 -0.314 . . . . 0.0 110.212 -178.684 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 150' ' ' ALA . . . . . 0.475 ' O ' ' O ' ' B' ' 149' ' ' LEU . . . -59.16 -135.93 0.0 OUTLIER 'General case' 0 C--O 1.219 -0.524 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.614 179.07 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 151' ' ' THR . . . . . 0.454 ' O ' ' O ' ' B' ' 150' ' ' ALA . 10.1 m 53.97 113.31 0.01 OUTLIER Pre-proline 0 CA--C 1.538 0.505 0 CA-C-N 116.574 -0.284 . . . . 0.0 110.67 179.915 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -48.68 -46.89 22.63 Favored 'Trans proline' 0 C--N 1.309 -1.503 0 C-N-CA 122.169 1.913 . . . . 0.0 113.209 -178.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 66.8 m -52.91 -38.77 62.18 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.541 0.686 . . . . 0.0 111.052 -179.359 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 3.5 mmp_? -71.75 -35.15 70.02 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.993 179.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 155' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -64.16 -55.77 19.46 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.43 -0.508 . . . . 0.0 111.603 -179.046 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 156' ' ' MET . . . . . 0.475 ' O ' ' OG1' ' B' ' 159' ' ' THR . 0.1 OUTLIER -56.73 -46.26 81.42 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 179.677 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 97.4 mt -62.82 -43.04 98.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 C-N-CA 120.199 -0.6 . . . . 0.0 110.209 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 58.4 tp -60.8 -42.59 97.93 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.287 -179.509 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 159' ' ' THR . . . . . 0.475 ' OG1' ' O ' ' B' ' 156' ' ' MET . 37.1 p -62.37 -35.37 78.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.112 -179.884 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 91.6 mm-40 -65.01 -50.75 65.04 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.965 0.412 . . . . 0.0 110.405 179.434 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 161' ' ' LEU . . . . . . . . . . . . . 82.2 mt -62.61 -32.64 73.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.72 179.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 162' ' ' ARG . . . . . . . . . . . . . 61.8 ttp180 -53.59 -39.04 64.52 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.33 -179.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 54.9 t-20 -61.19 -41.11 96.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.945 0.402 . . . . 0.0 110.405 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . 164.55 -176.7 40.38 Favored Glycine 0 CA--C 1.525 0.692 0 N-CA-C 111.12 -0.792 . . . . 0.0 111.12 179.433 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_exo -66.7 150.4 83.6 Favored 'Trans proline' 0 C--N 1.308 -1.6 0 C-N-CA 122.964 2.443 . . . . 0.0 111.937 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 1.7 pp -177.39 146.3 0.63 Allowed Pre-proline 0 N--CA 1.449 -0.509 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.573 178.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -74.53 174.99 11.66 Favored 'Trans proline' 0 N--CA 1.493 1.495 0 C-N-CA 122.873 2.382 . . . . 0.0 112.167 179.546 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . 3.6 m -71.42 -32.77 47.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 121.945 0.879 . . . . 0.0 110.808 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 169' ' ' THR . . . . . . . . . . . . . 50.4 p -58.16 -39.97 80.2 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-N 114.563 -1.199 . . . . 0.0 110.465 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 68.1 m-20 -68.53 -37.97 80.44 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.588 179.625 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.76 -38.59 91.66 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.096 -179.365 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 172' ' ' ALA . . . . . 0.517 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -62.81 -46.64 87.01 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.661 179.85 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -56.12 -44.66 79.35 Favored 'General case' 0 C--O 1.232 0.151 0 C-N-CA 120.46 -0.496 . . . . 0.0 109.943 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -59.96 -50.32 74.21 Favored 'General case' 0 C--O 1.231 0.091 0 C-N-CA 120.664 -0.414 . . . . 0.0 110.438 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 97.1 mt -93.35 -78.24 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.187 179.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 176' ' ' GLY . . . . . 0.517 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 142.29 91.62 0.17 Allowed Glycine 0 CA--C 1.519 0.336 0 N-CA-C 111.441 -0.664 . . . . 0.0 111.441 179.779 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 32.7 ttp 66.83 107.6 0.04 OUTLIER 'General case' 0 CA--C 1.518 -0.268 0 CA-C-O 120.66 0.267 . . . . 0.0 110.905 179.169 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 174.63 12.43 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.618 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -54.53 -38.14 66.22 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.61 -179.415 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 38.2 m -60.65 -48.29 82.43 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.855 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -57.08 -35.28 69.19 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.129 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 86.2 t -69.89 -53.37 24.31 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.774 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 77.6 p -57.14 -42.14 80.43 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.965 0.412 . . . . 0.0 110.572 -179.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 57.6 t-80 -63.92 -50.7 67.68 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-O 121.054 0.454 . . . . 0.0 110.794 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 85.6 mt-30 -62.3 -38.74 90.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.35 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 186' ' ' LEU . . . . . 0.401 ' CD2' ' CD1' ' B' ' 206' ' ' TYR . 58.1 tp -60.2 -45.14 94.18 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.219 -179.784 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 75.5 ttt180 -60.84 -44.45 96.95 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-O 121.135 0.493 . . . . 0.0 110.453 -179.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 88.9 t -66.74 -54.21 27.52 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.486 0 C-N-CA 120.121 -0.632 . . . . 0.0 110.709 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 97.7 mt -56.72 -41.32 77.25 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 -179.253 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 59.6 ttt85 -57.96 -39.97 79.42 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.237 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -61.19 -42.53 98.74 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 120.506 -0.478 . . . . 0.0 110.721 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 192' ' ' LEU . . . . . . . . . . . . . 6.1 mt -66.96 -42.38 85.3 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.958 0.409 . . . . 0.0 110.5 -179.284 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 101.82 95.47 2.26 Favored Glycine 0 CA--C 1.524 0.647 0 N-CA-C 111.474 -0.65 . . . . 0.0 111.474 179.65 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -170.71 -7.93 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.924 0.393 . . . . 0.0 110.586 179.139 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 22.4 m -136.79 156.11 34.45 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.08 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 196' ' ' VAL . . . . . . . . . . . . . 66.5 t -143.53 155.34 16.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.39 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 197' ' ' GLY . . . . . . . . . . . . . . . -127.03 146.37 16.32 Favored Glycine 0 N--CA 1.463 0.484 0 N-CA-C 110.351 -1.099 . . . . 0.0 110.351 179.519 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 96.6 m-20 . . . . . 0 C--O 1.234 0.264 0 CA-C-O 120.606 0.241 . . . . 0.0 110.489 -179.85 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 23.5 m . . . . . 0 C--O 1.234 0.282 0 CA-C-O 120.69 0.281 . . . . 0.0 110.429 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 206' ' ' TYR . . . . . 0.401 ' CD1' ' CD2' ' B' ' 186' ' ' LEU . 40.5 m-85 -114.22 137.63 51.53 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.646 -179.51 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 14.9 m -151.75 172.0 16.82 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.343 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 208' ' ' LEU . . . . . 0.522 ' N ' ' CD1' ' B' ' 208' ' ' LEU . 8.4 mp -75.79 148.11 38.7 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.555 179.763 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 67.5 t80 -52.71 -46.71 67.45 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.358 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 210' ' ' ASP . . . . . 0.544 ' CG ' ' H ' ' B' ' 211' ' ' THR . 43.5 t0 -157.01 -177.4 6.59 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.807 0.337 . . . . 0.0 110.505 -179.827 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 211' ' ' THR . . . . . 0.544 ' H ' ' CG ' ' B' ' 210' ' ' ASP . 4.8 t -77.09 4.77 9.48 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.483 -179.861 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 212' ' ' HIS . . . . . 0.534 ' CG ' ' CE1' ' A' ' 104' ' ' HIS . 35.1 m80 -60.35 -74.72 0.07 Allowed 'General case' 0 C--O 1.237 0.395 0 CA-C-O 121.016 0.436 . . . . 0.0 110.327 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 71.3 t -44.5 -39.82 1.78 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.352 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 214' ' ' ALA . . . . . . . . . . . . . . . -63.26 -39.4 94.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.501 179.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 215' ' ' GLN . . . . . 0.4 ' N ' ' O ' ' B' ' 212' ' ' HIS . 8.8 tp-100 -59.87 -47.51 85.44 Favored 'General case' 0 C--O 1.24 0.559 0 CA-C-O 121.146 0.498 . . . . 0.0 110.013 -179.521 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 216' ' ' LEU . . . . . 0.514 ' CD1' ' N ' ' B' ' 216' ' ' LEU . 7.3 mp -62.75 -42.62 99.76 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.146 -179.548 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 6.5 tp -63.73 -38.74 92.23 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.085 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 64.0 t0 -57.81 -46.19 85.03 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.928 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 219' ' ' GLU . . . . . 0.527 ' OE1' ' N ' ' B' ' 219' ' ' GLU . 0.3 OUTLIER -64.76 -50.72 65.73 Favored 'General case' 0 N--CA 1.462 0.163 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.37 179.631 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -57.75 -42.79 84.66 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 120.876 0.369 . . . . 0.0 110.565 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 4.1 mm -62.07 -44.36 98.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.6 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 80.2 t80 -62.22 -44.55 96.32 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.965 0.412 . . . . 0.0 110.324 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 223' ' ' HIS . . . . . 0.552 ' CE1' ' CG ' ' A' ' 93' ' ' HIS . 13.2 t60 -56.29 -44.9 80.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.675 -179.799 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 27.2 t -75.55 -36.34 60.47 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.939 179.669 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 80.3 tt0 -56.81 -37.93 71.88 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.308 -179.399 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 9.1 t60 . . . . . 0 C--N 1.332 -0.175 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.094 -179.467 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 . . . . . 0 N--CA 1.461 0.112 0 CA-C-O 120.927 0.394 . . . . 0.0 110.599 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 88.7 p -44.09 -50.05 8.63 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 121.334 0.588 . . . . 0.0 110.066 179.216 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -63.91 -44.46 92.87 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.191 179.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -57.39 -29.51 64.14 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.407 179.785 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -72.96 -50.58 22.51 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 120.885 0.374 . . . . 0.0 110.205 179.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.75 -41.98 95.5 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.912 179.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 72.6 tp60 -64.64 -52.94 54.73 Favored 'General case' 0 C--O 1.242 0.664 0 CA-C-O 121.255 0.55 . . . . 0.0 110.622 -179.399 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 93.0 t -63.17 -45.94 97.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.994 -179.808 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -53.43 -43.17 67.8 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.195 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 49.2 m -59.9 -44.15 94.43 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.799 0.333 . . . . 0.0 110.47 179.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 95.6 m -63.8 -51.0 66.75 Favored 'General case' 0 C--O 1.238 0.478 0 C-N-CA 120.619 -0.432 . . . . 0.0 110.835 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.431 ' N ' ' CD1' ' A' ' 27' ' ' LEU . 7.8 mp -66.94 -19.77 65.78 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.703 179.77 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 55.8 tt0 -74.82 -59.91 2.52 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.636 179.4 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -57.12 -52.15 66.46 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.445 -179.566 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 97.0 mt -54.81 -39.75 68.81 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.226 -179.173 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.561 ' O ' ' C ' ' A' ' 32' ' ' THR . . . -40.25 -73.33 0.05 OUTLIER 'General case' 0 CA--C 1.514 -0.442 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.299 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.561 ' C ' ' O ' ' A' ' 31' ' ' ALA . 94.9 m -2.98 107.08 0.03 OUTLIER Pre-proline 0 CA--C 1.539 0.533 0 O-C-N 124.556 1.16 . . . . 0.0 111.098 -179.339 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -44.19 -50.37 7.79 Favored 'Trans proline' 0 C--N 1.308 -1.577 0 C-N-CA 122.289 1.993 . . . . 0.0 113.039 -177.378 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 10.0 t -58.39 -46.78 85.7 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.034 -179.527 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 50.6 ttm-85 -64.09 -43.66 94.73 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.388 -179.505 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.43 ' CD2' ' HG1' ' A' ' 40' ' ' THR . 2.1 tt -61.09 -52.26 65.66 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.468 -0.493 . . . . 0.0 110.545 -178.915 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 49.0 ttp -53.87 -47.0 71.48 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.737 -0.385 . . . . 0.0 110.754 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 88.1 mt -60.81 -47.71 92.04 Favored 'Isoleucine or valine' 0 C--O 1.239 0.534 0 CA-C-O 121.36 0.6 . . . . 0.0 110.687 -179.254 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -62.56 -41.06 98.68 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.691 179.682 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.43 ' HG1' ' CD2' ' A' ' 36' ' ' LEU . 75.4 m -59.21 -40.53 86.09 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.861 179.799 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 53.6 tp60 -61.55 -44.99 96.04 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.311 -0.404 . . . . 0.0 109.989 -179.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.443 ' O ' ' N ' ' A' ' 44' ' ' ASN . 9.7 mt -66.83 -24.29 66.14 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.971 179.634 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.432 ' C ' ' O ' ' A' ' 42' ' ' LEU . 72.1 ttp85 -33.78 -35.71 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 O-C-N 123.578 0.549 . . . . 0.0 111.063 -179.347 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.443 ' N ' ' O ' ' A' ' 42' ' ' LEU . 58.0 t-20 -62.2 -72.92 0.11 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.212 179.26 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.429 ' H ' ' CD1' ' A' ' 47' ' ' LEU . . . 153.74 -75.07 0.24 Allowed Glycine 0 CA--C 1.526 0.778 0 N-CA-C 111.206 -0.758 . . . . 0.0 111.206 179.515 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.402 ' C ' ' CD1' ' A' ' 47' ' ' LEU . 71.6 Cg_endo -81.19 98.53 1.03 Allowed 'Trans proline' 0 C--N 1.312 -1.377 0 C-N-CA 122.655 2.237 . . . . 0.0 112.349 179.108 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.429 ' CD1' ' H ' ' A' ' 45' ' ' GLY . 5.1 mp -145.61 69.4 13.62 Favored Pre-proline 0 N--CA 1.465 0.28 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.236 179.475 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_exo -45.81 163.89 0.08 OUTLIER 'Trans proline' 0 C--N 1.308 -1.575 0 C-N-CA 122.563 2.175 . . . . 0.0 112.038 179.681 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 91.5 t -54.4 -47.07 70.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 121.129 0.49 . . . . 0.0 110.373 -178.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 66.4 p -63.98 -34.81 78.83 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.454 179.301 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -67.62 -39.94 84.68 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.807 179.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 16.5 mt -62.89 -40.01 96.22 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.925 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.569 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -59.67 -48.1 83.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.982 -0.554 . . . . 0.0 109.533 179.384 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 42.6 tp10 -56.91 -46.04 82.23 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.549 -0.46 . . . . 0.0 109.991 179.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -63.38 -51.21 66.8 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 120.73 -0.388 . . . . 0.0 110.662 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 97.5 mt -81.28 -71.0 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.519 -180.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . 0.569 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 130.53 75.01 0.14 Allowed Glycine 0 N--CA 1.463 0.449 0 N-CA-C 111.206 -0.757 . . . . 0.0 111.206 179.546 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 8.8 ttp 73.87 103.07 0.07 Allowed 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 120.993 -0.283 . . . . 0.0 110.848 179.343 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 179.89 17.68 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.383 179.608 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 9.2 mt-30 -51.75 -32.09 29.21 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.8 -179.349 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 50.9 m -66.8 -43.56 83.59 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.91 179.845 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.87 -30.66 71.73 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.252 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 75.1 t -72.78 -52.84 20.94 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.235 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.579 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 69.4 m -56.35 -45.33 80.48 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.416 -179.292 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 62.9 m-70 -62.87 -49.73 73.68 Favored 'General case' 0 C--O 1.239 0.501 0 CA-C-O 121.214 0.531 . . . . 0.0 111.004 179.786 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -62.49 -38.73 91.01 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.233 -179.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.5 tt -61.57 -43.34 99.04 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.646 -179.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -61.69 -42.02 98.37 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.934 -0.306 . . . . 0.0 110.616 179.77 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 89.2 t -64.48 -55.04 23.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 C-N-CA 120.135 -0.626 . . . . 0.0 110.678 -179.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 10.8 mp -61.73 -41.04 97.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.961 0.41 . . . . 0.0 110.132 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 79.0 ttt-85 -56.19 -41.72 76.01 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.094 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 8.2 t-20 -58.25 -49.89 75.51 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.6 -0.44 . . . . 0.0 110.228 -179.563 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.49 ' CD2' ' N ' ' A' ' 73' ' ' LEU . 4.0 mm? -68.09 -41.64 81.55 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.816 179.29 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 105.12 43.24 1.66 Allowed Glycine 0 CA--C 1.524 0.648 0 N-CA-C 111.076 -0.81 . . . . 0.0 111.076 -179.776 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.45 ' N ' ' CD1' ' A' ' 75' ' ' LEU . 9.0 mp -97.4 -15.22 20.77 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 110.448 -0.204 . . . . 0.0 110.448 179.378 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 30.5 m -136.83 160.22 36.95 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.344 0 CA-C-O 120.801 0.334 . . . . 0.0 110.334 -179.85 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.412 ' CG1' ' N ' ' A' ' 78' ' ' GLY . 51.5 t -140.16 155.48 23.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.356 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . 0.412 ' N ' ' CG1' ' A' ' 77' ' ' VAL . . . -126.66 149.67 17.64 Favored Glycine 0 CA--C 1.521 0.431 0 N-CA-C 110.515 -1.034 . . . . 0.0 110.515 179.612 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 16.8 t70 . . . . . 0 C--O 1.236 0.388 0 N-CA-C 110.256 -0.276 . . . . 0.0 110.256 179.952 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 77.3 t . . . . . 0 N--CA 1.469 0.505 0 CA-C-O 120.629 0.252 . . . . 0.0 110.653 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -99.51 130.02 45.72 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.198 179.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 31.3 p -146.01 165.77 28.03 Favored 'General case' 0 C--O 1.224 -0.263 0 N-CA-C 109.816 -0.439 . . . . 0.0 109.816 -179.379 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.519 ' N ' ' CD1' ' A' ' 89' ' ' LEU . 8.0 mp -67.53 147.5 52.72 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.369 -179.416 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 61.3 t80 -50.55 -42.38 55.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.426 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 46.8 p30 -146.71 179.68 7.4 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.508 -0.315 . . . . 0.0 110.4 -179.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 28.1 m -95.27 -17.65 21.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.499 -179.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . 0.478 ' CG ' ' HD1' ' B' ' 223' ' ' HIS . 92.2 m-70 -40.97 -66.1 0.36 Allowed 'General case' 0 C--O 1.235 0.322 0 CA-C-O 121.368 0.604 . . . . 0.0 110.964 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 8.3 p -47.5 -34.89 3.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.347 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.08 -39.75 94.73 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.303 179.569 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -59.47 -45.43 91.66 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.919 -179.773 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.489 ' N ' ' CD1' ' A' ' 97' ' ' LEU . 8.3 mp -60.74 -44.15 97.03 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.336 -0.546 . . . . 0.0 109.875 -179.315 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 6.1 tp -64.8 -38.33 90.62 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.526 179.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 63.9 t0 -57.05 -46.57 82.32 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.984 -179.487 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -70.32 -47.86 59.2 Favored 'General case' 0 C--O 1.232 0.152 0 C-N-CA 120.566 -0.454 . . . . 0.0 110.105 179.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -53.46 -47.87 69.35 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.461 179.602 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 4.3 mm -63.09 -44.59 99.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 C-N-CA 120.626 -0.43 . . . . 0.0 110.64 -179.511 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 86.5 t80 -60.37 -41.42 93.68 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.018 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' HIS . . . . . 0.504 ' HD1' ' CG ' ' B' ' 212' ' ' HIS . 64.7 t60 -69.28 -39.85 78.1 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.716 179.61 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 48.3 t -57.86 -47.82 81.59 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.544 -178.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -76.89 -54.45 6.58 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.94 0.4 . . . . 0.0 111.411 179.212 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 83.6 t60 . . . . . 0 CA--C 1.517 -0.318 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.268 -178.762 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 . . . . . 0 N--CA 1.463 0.19 0 CA-C-O 121.013 0.435 . . . . 0.0 110.591 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 83.4 p -44.51 -50.89 9.28 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.231 179.303 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -63.48 -44.01 95.65 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.235 179.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 138' ' ' ALA . . . . . . . . . . . . . . . -57.73 -29.35 64.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.383 179.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -72.62 -50.33 26.02 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 121.106 0.479 . . . . 0.0 110.222 179.497 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -65.01 -40.94 95.64 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.724 179.67 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 66.1 tp60 -65.19 -53.59 42.35 Favored 'General case' 0 C--O 1.241 0.62 0 CA-C-O 121.272 0.558 . . . . 0.0 110.761 -179.298 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 142' ' ' VAL . . . . . . . . . . . . . 92.6 t -62.97 -46.47 96.24 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.881 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -52.25 -43.67 64.48 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.229 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 51.0 m -59.88 -44.2 94.32 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.4 179.797 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 22.8 m -63.08 -51.76 65.37 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 120.493 -0.483 . . . . 0.0 111.065 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 146' ' ' LEU . . . . . 0.453 ' N ' ' CD1' ' B' ' 146' ' ' LEU . 7.7 mp -66.82 -19.79 65.81 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.667 179.761 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 147' ' ' GLN . . . . . . . . . . . . . 57.8 tt0 -74.38 -61.01 2.01 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.62 179.548 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -56.58 -51.63 67.9 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.631 -179.524 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.403 ' O ' ' C ' ' B' ' 150' ' ' ALA . 97.1 mt -55.2 -39.97 70.24 Favored 'General case' 0 CA--C 1.515 -0.386 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.307 -179.105 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 150' ' ' ALA . . . . . 0.558 ' O ' ' C ' ' B' ' 151' ' ' THR . . . -40.18 -73.94 0.04 OUTLIER 'General case' 0 CA--C 1.513 -0.464 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.262 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 151' ' ' THR . . . . . 0.558 ' C ' ' O ' ' B' ' 150' ' ' ALA . 92.4 m -2.24 106.87 0.03 OUTLIER Pre-proline 0 CA--C 1.539 0.528 0 O-C-N 124.627 1.204 . . . . 0.0 110.994 -179.333 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -43.72 -50.54 7.04 Favored 'Trans proline' 0 C--N 1.307 -1.638 0 C-N-CA 122.231 1.954 . . . . 0.0 112.977 -177.169 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 11.1 t -58.56 -46.32 87.13 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.985 -179.344 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 50.6 ttm-85 -63.68 -44.65 93.1 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 120.708 -0.397 . . . . 0.0 110.526 -179.497 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 155' ' ' LEU . . . . . 0.435 ' CD2' ' OG1' ' B' ' 159' ' ' THR . 1.6 tt -60.88 -51.41 69.42 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.543 -0.463 . . . . 0.0 110.464 -178.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 50.4 ttp -54.07 -47.53 71.59 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.583 -0.447 . . . . 0.0 110.942 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 90.5 mt -61.1 -47.51 93.24 Favored 'Isoleucine or valine' 0 C--O 1.239 0.526 0 CA-C-O 121.228 0.537 . . . . 0.0 110.58 -179.326 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -62.51 -41.16 98.66 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.654 179.467 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 159' ' ' THR . . . . . 0.435 ' OG1' ' CD2' ' B' ' 155' ' ' LEU . 18.6 m -59.37 -40.11 85.43 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.813 179.718 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 56.4 tp60 -61.6 -45.23 94.98 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.061 0.458 . . . . 0.0 109.921 -179.71 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 161' ' ' LEU . . . . . 0.438 ' O ' ' N ' ' B' ' 163' ' ' ASN . 9.5 mt -66.39 -23.84 66.39 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.96 179.702 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 162' ' ' ARG . . . . . 0.436 ' C ' ' O ' ' B' ' 161' ' ' LEU . 72.1 ttp85 -34.05 -35.54 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 O-C-N 123.533 0.521 . . . . 0.0 111.114 -179.214 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 163' ' ' ASN . . . . . 0.438 ' N ' ' O ' ' B' ' 161' ' ' LEU . 58.8 t-20 -61.77 -71.41 0.15 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.26 179.382 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 164' ' ' GLY . . . . . 0.409 ' H ' ' CD1' ' B' ' 166' ' ' LEU . . . 153.36 -76.33 0.22 Allowed Glycine 0 CA--C 1.527 0.822 0 N-CA-C 111.157 -0.777 . . . . 0.0 111.157 179.545 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 165' ' ' PRO . . . . . 0.422 ' C ' ' CD1' ' B' ' 166' ' ' LEU . 74.3 Cg_endo -82.08 101.74 1.16 Allowed 'Trans proline' 0 N--CA 1.492 1.391 0 C-N-CA 122.605 2.203 . . . . 0.0 112.182 179.174 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 166' ' ' LEU . . . . . 0.422 ' CD1' ' C ' ' B' ' 165' ' ' PRO . 5.3 mp -146.61 69.76 12.44 Favored Pre-proline 0 N--CA 1.464 0.246 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.397 179.666 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_exo -45.57 163.09 0.09 OUTLIER 'Trans proline' 0 C--N 1.307 -1.614 0 C-N-CA 122.52 2.147 . . . . 0.0 112.049 179.431 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . 87.6 t -53.85 -46.79 64.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 121.099 0.476 . . . . 0.0 110.402 -179.195 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 169' ' ' THR . . . . . . . . . . . . . 64.2 p -63.94 -35.46 80.74 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.472 179.374 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -66.79 -40.14 88.02 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.095 179.621 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 16.5 mt -63.12 -40.55 97.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.137 179.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 172' ' ' ALA . . . . . 0.577 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -59.06 -47.86 83.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.487 179.48 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 42.3 tp10 -57.02 -45.93 82.74 Favored 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 120.46 -0.496 . . . . 0.0 110.029 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -63.31 -49.72 72.89 Favored 'General case' 0 C--O 1.231 0.103 0 C-N-CA 120.669 -0.412 . . . . 0.0 110.717 -179.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 175' ' ' ILE . . . . . 0.431 HG22 HD13 ' B' ' 175' ' ' ILE . 96.3 mt -82.62 -71.16 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.432 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 176' ' ' GLY . . . . . 0.577 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 129.8 74.25 0.14 Allowed Glycine 0 N--CA 1.463 0.476 0 N-CA-C 111.205 -0.758 . . . . 0.0 111.205 179.419 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 177' ' ' MET . . . . . 0.421 ' CB ' ' O ' ' B' ' 176' ' ' GLY . 3.4 tmm? 75.43 102.08 0.07 Allowed 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 120.668 -0.413 . . . . 0.0 110.879 179.407 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 179.26 18.08 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.335 179.679 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 12.1 mt-30 -52.5 -32.01 38.1 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.651 -179.299 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 47.0 m -66.4 -43.44 85.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.921 0.391 . . . . 0.0 110.903 179.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -63.92 -30.77 71.83 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.365 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 94.5 t -72.78 -52.86 20.83 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.244 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.777 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 74.3 m -56.49 -45.49 80.95 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.456 -179.48 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 58.6 m-70 -62.22 -48.91 77.89 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.111 0.481 . . . . 0.0 110.661 179.789 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -62.9 -39.72 95.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.262 -179.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 5.4 tt -61.05 -43.31 99.07 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.559 -179.722 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -61.81 -42.36 98.92 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 120.979 -0.288 . . . . 0.0 110.687 179.712 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 99.4 t -64.18 -54.89 25.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 C-N-CA 120.158 -0.617 . . . . 0.0 110.691 -179.663 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 10.6 mp -61.75 -41.08 97.2 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.81 0.338 . . . . 0.0 110.164 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 79.5 ttt-85 -54.91 -42.52 72.3 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.156 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -57.82 -50.48 73.13 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.504 -0.478 . . . . 0.0 110.335 -179.683 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 192' ' ' LEU . . . . . 0.501 ' CD2' ' N ' ' B' ' 192' ' ' LEU . 3.9 mm? -66.76 -42.91 85.4 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.851 0.358 . . . . 0.0 110.853 179.496 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 105.77 42.14 1.74 Allowed Glycine 0 CA--C 1.525 0.717 0 N-CA-C 111.154 -0.778 . . . . 0.0 111.154 -179.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 194' ' ' LEU . . . . . 0.466 ' N ' ' CD1' ' B' ' 194' ' ' LEU . 8.1 mp -96.46 -15.1 21.92 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 120.496 0.189 . . . . 0.0 110.682 179.643 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 29.4 m -138.27 161.92 30.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.773 0.321 . . . . 0.0 110.269 -179.771 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 196' ' ' VAL . . . . . 0.429 ' CG1' ' N ' ' B' ' 197' ' ' GLY . 61.9 t -141.87 157.99 20.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.535 179.42 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 197' ' ' GLY . . . . . 0.429 ' N ' ' CG1' ' B' ' 196' ' ' VAL . . . -129.53 149.38 18.66 Favored Glycine 0 CA--C 1.521 0.447 0 N-CA-C 110.625 -0.99 . . . . 0.0 110.625 179.437 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 17.8 t70 . . . . . 0 C--O 1.237 0.428 0 CA-C-O 120.863 0.363 . . . . 0.0 110.709 -179.711 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 70.7 t . . . . . 0 N--CA 1.463 0.178 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 77.0 m-85 -102.59 132.7 48.51 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.468 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 36.1 p -150.07 169.26 21.65 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.029 -179.413 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 208' ' ' LEU . . . . . 0.529 ' N ' ' CD1' ' B' ' 208' ' ' LEU . 7.8 mp -68.78 149.18 49.29 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.566 -179.28 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 59.3 t80 -53.46 -43.81 68.42 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.547 179.709 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 40.7 p30 -144.47 179.9 6.97 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.42 -179.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 25.4 m -96.16 -17.8 20.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.596 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 212' ' ' HIS . . . . . 0.504 ' CG ' ' HD1' ' A' ' 104' ' ' HIS . 89.4 m-70 -40.77 -65.82 0.38 Allowed 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 121.38 0.61 . . . . 0.0 110.706 179.674 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 7.5 p -47.57 -34.45 3.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.345 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 214' ' ' ALA . . . . . . . . . . . . . . . -65.45 -38.25 89.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.08 179.491 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -60.89 -45.57 94.1 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.032 -179.772 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 216' ' ' LEU . . . . . 0.495 ' CD1' ' N ' ' B' ' 216' ' ' LEU . 8.2 mp -61.09 -43.72 98.45 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.445 -0.502 . . . . 0.0 109.712 -179.579 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 7.1 tp -64.47 -40.21 95.27 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.461 179.309 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 65.7 t0 -56.44 -46.31 80.35 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.028 -179.49 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 219' ' ' GLU . . . . . . . . . . . . . 16.7 tp10 -70.13 -48.94 55.36 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.146 179.724 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -53.22 -47.53 68.89 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.331 179.584 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 4.5 mm -62.99 -44.6 99.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.597 -179.71 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 90.0 t80 -60.02 -42.82 95.18 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.985 -179.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 223' ' ' HIS . . . . . 0.478 ' HD1' ' CG ' ' A' ' 93' ' ' HIS . 47.8 t60 -68.41 -38.69 81.48 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.619 179.247 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 11.5 t -57.41 -48.78 78.19 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.648 -178.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -77.14 -53.19 8.07 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.958 0.408 . . . . 0.0 111.428 179.111 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 86.2 t60 . . . . . 0 CA--C 1.518 -0.261 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.274 -178.794 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 . . . . . 0 N--CA 1.464 0.27 0 CA-C-O 120.781 0.324 . . . . 0.0 110.645 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 11.4 t -56.43 -48.16 77.55 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-O 121.362 0.601 . . . . 0.0 109.723 179.338 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 90.7 mm-40 -65.3 -47.48 76.45 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.02 179.42 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -56.31 -29.12 60.82 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.237 -179.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -71.28 -49.71 40.2 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 120.867 -0.333 . . . . 0.0 110.152 179.554 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.25 -44.01 95.62 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.525 179.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -59.4 -49.36 78.09 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-O 121.162 0.506 . . . . 0.0 110.352 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.468 ' O ' ' OG1' ' A' ' 26' ' ' THR . 84.4 t -61.71 -44.26 98.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.025 179.626 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.78 -41.9 82.99 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 120.876 0.37 . . . . 0.0 110.032 179.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 48.3 t -58.76 -44.84 90.69 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.021 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.468 ' OG1' ' O ' ' A' ' 23' ' ' VAL . 71.3 p -64.42 -47.28 79.73 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 120.989 0.423 . . . . 0.0 110.566 179.362 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 95.1 mt -63.95 -23.77 67.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.406 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 54.9 tt0 -75.65 -56.49 4.64 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.733 179.542 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.65 -55.1 39.38 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.786 -179.333 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.478 ' O ' ' O ' ' A' ' 31' ' ' ALA . 3.8 mm? -46.8 -35.14 5.92 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 -179.18 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.478 ' O ' ' O ' ' A' ' 30' ' ' LEU . . . -55.07 -161.92 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.064 -0.517 . . . . 0.0 109.858 179.428 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.531 ' CB ' HH11 ' A' ' 35' ' ' ARG . 1.0 OUTLIER 81.86 114.41 0.03 OUTLIER Pre-proline 0 C--N 1.323 -0.544 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.182 179.827 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -49.19 -42.6 39.34 Favored 'Trans proline' 0 N--CA 1.496 1.641 0 C-N-CA 122.265 1.977 . . . . 0.0 112.957 -179.14 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 47.4 t -59.36 -45.54 91.11 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.881 -179.191 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.531 HH11 ' CB ' ' A' ' 32' ' ' THR . 84.6 mtt85 -62.03 -44.31 96.98 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.738 -0.385 . . . . 0.0 111.186 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -61.3 -47.59 85.27 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.476 -0.49 . . . . 0.0 110.96 -179.52 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.435 ' O ' ' OE1' ' A' ' 41' ' ' GLN . 20.2 ttm -56.54 -48.95 76.19 Favored 'General case' 0 C--N 1.319 -0.743 0 C-N-CA 120.285 -0.566 . . . . 0.0 110.301 -179.804 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.415 HG23 HD13 ' A' ' 38' ' ' ILE . 37.8 mm -63.5 -43.66 98.45 Favored 'Isoleucine or valine' 0 C--O 1.234 0.256 0 CA-C-O 121.045 0.45 . . . . 0.0 110.44 -179.752 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 mt -62.15 -39.75 93.66 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.456 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 18.0 m -60.55 -43.72 96.9 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.101 -0.5 . . . . 0.0 109.981 179.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.435 ' OE1' ' O ' ' A' ' 37' ' ' MET . 3.4 mp0 -61.31 -44.9 96.44 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.985 0.422 . . . . 0.0 110.041 179.809 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 97.9 mt -61.79 -40.23 94.47 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.066 -179.434 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.536 ' NH2' ' OD2' ' A' ' 99' ' ' ASP . 20.3 tpt180 -63.72 -37.67 88.21 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.951 179.974 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -56.95 -42.33 79.91 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.692 -178.54 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 169.38 -174.49 43.77 Favored Glycine 0 CA--C 1.527 0.786 0 N-CA-C 111.007 -0.837 . . . . 0.0 111.007 179.724 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -77.83 122.34 5.83 Favored 'Trans proline' 0 C--N 1.311 -1.408 0 C-N-CA 122.819 2.346 . . . . 0.0 111.663 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -150.16 95.89 3.55 Favored Pre-proline 0 CA--C 1.537 0.451 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.961 -179.248 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_exo -47.06 173.22 0.03 OUTLIER 'Trans proline' 0 C--N 1.306 -1.664 0 C-N-CA 122.495 2.13 . . . . 0.0 112.284 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 73.0 t -54.64 -45.02 72.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.433 -179.23 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 15.3 m -59.78 -40.24 87.62 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.22 0.533 . . . . 0.0 110.255 179.208 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 56.3 t0 -65.71 -38.98 90.68 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.16 179.517 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.46 -44.19 97.0 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-O 121.308 0.575 . . . . 0.0 110.028 -179.565 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.497 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -55.87 -48.44 75.57 Favored 'General case' 0 N--CA 1.444 -0.738 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 179.707 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 44.9 tp10 -56.48 -48.43 77.14 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.318 -0.553 . . . . 0.0 110.549 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -54.29 -58.07 8.8 Favored 'General case' 0 C--N 1.332 -0.163 0 C-N-CA 120.896 -0.322 . . . . 0.0 110.614 -179.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 90.6 mt -86.35 -73.16 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.417 179.775 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . 0.497 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 131.88 98.09 0.72 Allowed Glycine 0 N--CA 1.461 0.316 0 N-CA-C 111.055 -0.818 . . . . 0.0 111.055 -179.679 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 64.3 mtt 66.48 99.54 0.05 OUTLIER 'General case' 0 C--N 1.34 0.18 0 CA-C-O 120.767 0.317 . . . . 0.0 110.722 178.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -179.53 15.12 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.359 179.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 -55.54 -36.9 67.29 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.549 -179.372 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.596 ' HG ' ' H ' ' A' ' 62' ' ' ALA . 78.1 p -62.09 -49.29 76.53 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.821 -179.719 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.596 ' H ' ' HG ' ' A' ' 61' ' ' SER . . . -58.34 -35.87 72.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.278 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 75.8 t -67.19 -52.95 37.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.596 -179.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 10.4 t -56.84 -42.29 79.38 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.248 -179.416 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -63.17 -49.8 72.88 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.816 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 86.6 mm-40 -63.72 -41.17 98.12 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.594 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.8 tp -62.52 -44.66 95.82 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.359 -179.679 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 70.4 mmt-85 -62.43 -42.42 99.44 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.848 0.356 . . . . 0.0 110.66 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 71.9 t -67.23 -54.37 24.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 C-N-CA 120.262 -0.575 . . . . 0.0 110.468 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 92.4 mt -58.49 -41.4 85.24 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.063 -179.323 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 73.5 ttt180 -58.55 -41.67 86.14 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.405 179.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 93.3 m-20 -57.65 -50.39 73.32 Favored 'General case' 0 C--N 1.332 -0.171 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.455 -179.421 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.8 mt -67.7 -40.76 84.3 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.934 0.397 . . . . 0.0 110.407 -179.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 103.09 78.76 1.31 Allowed Glycine 0 CA--C 1.52 0.398 0 N-CA-C 110.872 -0.891 . . . . 0.0 110.872 -179.644 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 6.7 tp -144.9 -9.35 0.61 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.943 0.401 . . . . 0.0 110.793 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 33.8 m -139.05 158.34 29.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.454 -179.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.435 ' O ' ' O ' ' A' ' 88' ' ' SER . 48.4 t -143.99 157.69 15.87 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.577 -179.793 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -134.44 144.48 16.45 Favored Glycine 0 CA--C 1.521 0.463 0 N-CA-C 110.388 -1.085 . . . . 0.0 110.388 179.623 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 46.9 t0 . . . . . 0 C--O 1.234 0.243 0 CA-C-O 120.919 0.39 . . . . 0.0 110.343 179.519 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 46.6 t . . . . . 0 C--O 1.224 -0.278 0 CA-C-O 120.752 0.31 . . . . 0.0 110.218 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -106.88 131.47 53.93 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.288 179.749 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.435 ' O ' ' O ' ' A' ' 77' ' ' VAL . 99.9 p -150.09 166.88 28.42 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.487 ' O ' ' N ' ' A' ' 91' ' ' ASP . 0.3 OUTLIER -78.9 154.16 29.93 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.175 -179.361 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.566 ' CD2' ' OG1' ' A' ' 92' ' ' THR . 71.0 t80 -46.17 -15.55 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.434 179.688 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.487 ' N ' ' O ' ' A' ' 89' ' ' LEU . 52.8 t0 41.94 89.81 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.189 179.055 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' THR . . . . . 0.566 ' OG1' ' CD2' ' A' ' 90' ' ' TYR . 2.1 m -169.58 -133.8 0.02 OUTLIER 'General case' 0 C--O 1.236 0.353 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.56 179.656 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . 0.423 ' H ' ' CG2' ' A' ' 92' ' ' THR . 40.4 m80 -55.08 -53.06 60.65 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.021 -179.89 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 95.3 t -49.78 -39.53 14.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.245 179.754 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.52 -41.44 98.86 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.485 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 58.6 tt0 -60.65 -46.34 90.71 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.006 0.432 . . . . 0.0 110.11 -179.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.498 HD13 ' N ' ' B' ' 220' ' ' ALA . 3.7 mm? -62.32 -43.14 99.52 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.433 179.677 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 62.3 tp -65.06 -39.29 93.07 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.422 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . 0.536 ' OD2' ' NH2' ' A' ' 43' ' ' ARG . 94.2 m-20 -62.71 -39.84 95.27 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.154 0.502 . . . . 0.0 110.839 -178.983 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.464 ' OE2' ' OE2' ' B' ' 219' ' ' GLU . 97.5 mt-10 -74.16 -52.62 11.93 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.825 179.67 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . 0.484 ' N ' HD13 ' B' ' 216' ' ' LEU . . . -57.89 -48.37 80.06 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.965 -179.629 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . 0.538 ' CG2' ' N ' ' A' ' 103' ' ' TYR . 10.4 tp -64.73 -46.1 93.2 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 CA-C-O 120.892 0.377 . . . . 0.0 111.111 -179.096 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' TYR . . . . . 0.538 ' N ' ' CG2' ' A' ' 102' ' ' ILE . 91.0 t80 -62.98 -43.97 97.31 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.783 -179.422 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 3.4 m-70 -67.31 -41.44 85.32 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.756 -179.734 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 6.4 t -67.93 -44.29 77.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.977 0.417 . . . . 0.0 110.744 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 15.1 tm-20 -67.63 -29.2 68.46 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.569 -179.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 18.7 t60 . . . . . 0 N--CA 1.454 -0.26 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.262 -178.946 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 . . . . . 0 N--CA 1.464 0.255 0 CA-C-O 120.833 0.349 . . . . 0.0 110.639 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 9.9 t -55.15 -48.68 73.38 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.236 0.541 . . . . 0.0 109.788 179.514 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 95.6 mm-40 -65.36 -47.6 75.88 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.937 179.535 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 138' ' ' ALA . . . . . . . . . . . . . . . -56.02 -29.81 60.93 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.196 -179.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -71.28 -49.88 38.34 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 120.888 0.375 . . . . 0.0 110.156 179.653 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -61.1 -41.14 96.12 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.529 179.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -61.21 -49.86 75.45 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-O 121.214 0.531 . . . . 0.0 110.427 179.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 142' ' ' VAL . . . . . 0.474 ' O ' ' OG1' ' B' ' 145' ' ' THR . 93.5 t -61.78 -44.46 98.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.145 179.697 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -57.01 -42.19 79.88 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 120.804 0.335 . . . . 0.0 110.167 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 14.0 t -58.71 -44.97 90.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.98 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 145' ' ' THR . . . . . 0.474 ' OG1' ' O ' ' B' ' 142' ' ' VAL . 77.5 p -64.2 -46.36 84.27 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 120.967 0.413 . . . . 0.0 110.451 179.466 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 95.4 mt -64.51 -23.4 67.26 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.435 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 147' ' ' GLN . . . . . . . . . . . . . 57.1 tt0 -75.64 -56.36 4.76 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.785 179.527 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -59.12 -55.2 38.03 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.766 -179.393 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.467 ' O ' ' O ' ' B' ' 150' ' ' ALA . 3.8 mm? -46.66 -36.38 6.99 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 -179.127 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 150' ' ' ALA . . . . . 0.479 ' O ' ' CB ' ' B' ' 151' ' ' THR . . . -54.86 -162.2 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.927 179.602 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 151' ' ' THR . . . . . 0.547 ' CB ' HH11 ' B' ' 154' ' ' ARG . 0.6 OUTLIER 82.79 115.07 0.03 OUTLIER Pre-proline 0 CA--C 1.54 0.564 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.294 179.694 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -48.98 -42.68 37.74 Favored 'Trans proline' 0 N--CA 1.496 1.618 0 C-N-CA 122.18 1.92 . . . . 0.0 113.063 -179.303 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 39.6 t -60.16 -45.97 91.28 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.976 -179.131 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 154' ' ' ARG . . . . . 0.547 HH11 ' CB ' ' B' ' 151' ' ' THR . 84.4 mtt85 -62.56 -43.6 98.41 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.125 -179.722 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 155' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -62.69 -47.0 85.52 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.72 -0.392 . . . . 0.0 111.036 -179.479 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 36.4 ttp -58.34 -48.92 79.01 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.266 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 35.3 mm -63.28 -43.84 98.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 121.054 0.454 . . . . 0.0 110.371 179.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 36.9 mt -61.5 -40.68 95.48 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.222 -179.709 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 19.9 m -59.97 -45.14 93.66 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.005 179.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -58.03 -45.1 87.5 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.676 -0.41 . . . . 0.0 109.991 179.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 161' ' ' LEU . . . . . . . . . . . . . 97.0 mt -62.03 -40.07 94.47 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.122 0.486 . . . . 0.0 109.996 -179.47 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 162' ' ' ARG . . . . . 0.548 ' NH2' ' OD2' ' B' ' 218' ' ' ASP . 21.5 tpt180 -63.52 -37.99 89.41 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.951 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 98.4 m-20 -56.57 -42.09 78.04 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.588 -178.64 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . 169.43 -175.91 43.56 Favored Glycine 0 CA--C 1.528 0.876 0 N-CA-C 110.997 -0.841 . . . . 0.0 110.997 179.665 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -76.99 123.26 6.66 Favored 'Trans proline' 0 N--CA 1.492 1.413 0 C-N-CA 122.856 2.371 . . . . 0.0 111.593 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -150.61 96.38 3.39 Favored Pre-proline 0 CA--C 1.538 0.504 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.016 -179.238 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_exo -47.06 173.31 0.03 OUTLIER 'Trans proline' 0 C--N 1.306 -1.71 0 C-N-CA 122.456 2.104 . . . . 0.0 112.309 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . 81.7 t -54.77 -45.2 73.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.43 -179.292 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 169' ' ' THR . . . . . . . . . . . . . 15.7 m -59.99 -40.28 88.61 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.186 0.517 . . . . 0.0 110.229 179.199 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -65.45 -38.64 90.45 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.191 179.297 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.63 -44.82 95.33 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.272 0.558 . . . . 0.0 110.011 -179.587 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 172' ' ' ALA . . . . . 0.486 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -55.66 -48.07 75.64 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 179.782 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 43.6 tp10 -56.04 -48.39 76.07 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.308 -0.557 . . . . 0.0 110.502 179.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -54.82 -58.35 7.93 Favored 'General case' 0 C--N 1.333 -0.136 0 C-N-CA 120.749 -0.38 . . . . 0.0 110.776 -179.511 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 87.7 mt -86.62 -72.98 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.454 179.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 176' ' ' GLY . . . . . 0.486 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 130.54 99.41 0.84 Allowed Glycine 0 N--CA 1.461 0.323 0 N-CA-C 111.119 -0.792 . . . . 0.0 111.119 -179.779 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 62.5 mtt 66.27 95.71 0.06 Allowed 'General case' 0 CA--C 1.521 -0.172 0 CA-C-O 120.887 0.375 . . . . 0.0 110.745 178.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -176.71 14.65 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.404 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 54.8 mt-30 -55.79 -37.07 68.11 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.64 -179.247 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 180' ' ' SER . . . . . 0.569 ' HG ' ' H ' ' B' ' 181' ' ' ALA . 64.3 p -61.49 -48.43 81.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.036 -179.726 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 181' ' ' ALA . . . . . 0.569 ' H ' ' HG ' ' B' ' 180' ' ' SER . . . -59.2 -35.4 73.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.233 -179.902 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 97.5 t -67.12 -52.91 38.38 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.101 0 C-N-CA 120.467 -0.493 . . . . 0.0 110.726 -179.713 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 10.7 t -57.11 -42.18 80.33 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.289 -179.576 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 86.0 t60 -63.42 -50.27 70.48 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.905 -179.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 90.6 mm-40 -63.69 -40.48 96.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.949 0.404 . . . . 0.0 110.668 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 8.6 tp -62.52 -44.94 95.13 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.403 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 73.1 mmt-85 -62.46 -42.31 99.38 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.746 -179.761 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 77.7 t -66.34 -54.58 24.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 C-N-CA 120.179 -0.608 . . . . 0.0 110.506 -179.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 87.2 mt -58.83 -41.15 86.19 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 -179.251 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 71.8 ttt180 -57.95 -41.37 82.69 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.272 179.704 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 -59.82 -49.87 76.03 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 120.488 -0.485 . . . . 0.0 110.447 -179.33 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 192' ' ' LEU . . . . . . . . . . . . . 9.2 mt -67.55 -39.41 84.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.816 0.341 . . . . 0.0 110.464 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 101.28 80.98 1.54 Allowed Glycine 0 N--CA 1.462 0.42 0 N-CA-C 110.727 -0.949 . . . . 0.0 110.727 -179.639 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 4.9 tp -147.47 -9.68 0.42 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.777 0.322 . . . . 0.0 110.768 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 26.7 m -140.05 159.18 26.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.412 -179.636 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 196' ' ' VAL . . . . . 0.443 ' O ' ' O ' ' B' ' 207' ' ' SER . 47.7 t -145.62 159.62 12.46 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.493 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 197' ' ' GLY . . . . . . . . . . . . . . . -135.68 145.21 17.22 Favored Glycine 0 CA--C 1.523 0.563 0 N-CA-C 110.409 -1.077 . . . . 0.0 110.409 179.615 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 67.3 t0 . . . . . 0 C--O 1.234 0.27 0 CA-C-O 120.868 0.366 . . . . 0.0 110.337 179.564 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 47.2 t . . . . . 0 N--CA 1.465 0.304 0 CA-C-O 120.785 0.326 . . . . 0.0 110.179 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 96.3 m-85 -106.07 131.97 52.7 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.417 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 207' ' ' SER . . . . . 0.443 ' O ' ' O ' ' B' ' 196' ' ' VAL . 40.6 p -150.52 167.26 27.72 Favored 'General case' 0 CA--C 1.52 -0.196 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 208' ' ' LEU . . . . . 0.473 ' C ' ' H ' ' B' ' 210' ' ' ASP . 0.3 OUTLIER -78.97 154.12 29.81 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.224 -179.158 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 209' ' ' TYR . . . . . 0.554 ' CD2' ' OG1' ' B' ' 211' ' ' THR . 66.4 t80 -46.36 -15.85 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.805 0.336 . . . . 0.0 110.529 179.647 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 210' ' ' ASP . . . . . 0.473 ' H ' ' C ' ' B' ' 208' ' ' LEU . 35.5 t0 42.45 89.72 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.21 179.107 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 211' ' ' THR . . . . . 0.554 ' OG1' ' CD2' ' B' ' 209' ' ' TYR . 2.3 m -169.32 -134.77 0.02 OUTLIER 'General case' 0 C--O 1.238 0.47 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.471 179.634 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 212' ' ' HIS . . . . . 0.451 ' H ' ' CG2' ' B' ' 211' ' ' THR . 40.4 m80 -55.36 -53.51 55.3 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.02 -179.904 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 92.9 t -48.9 -38.88 11.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.214 179.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 214' ' ' ALA . . . . . . . . . . . . . . . -63.26 -42.24 99.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.347 179.831 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 58.8 tt0 -58.78 -46.62 87.1 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.073 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 216' ' ' LEU . . . . . 0.484 HD13 ' N ' ' A' ' 101' ' ' ALA . 3.5 mm? -61.99 -42.69 99.42 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.441 179.647 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 58.1 tp -65.4 -39.97 92.83 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.509 179.75 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 218' ' ' ASP . . . . . 0.548 ' OD2' ' NH2' ' B' ' 162' ' ' ARG . 98.8 m-20 -62.46 -40.16 95.74 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.163 0.506 . . . . 0.0 110.975 -178.941 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 219' ' ' GLU . . . . . 0.464 ' OE2' ' OE2' ' A' ' 100' ' ' GLU . 97.0 mt-10 -74.36 -53.45 9.62 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.807 179.564 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 220' ' ' ALA . . . . . 0.498 ' N ' HD13 ' A' ' 97' ' ' LEU . . . -56.8 -48.75 77.25 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.852 -179.305 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 221' ' ' ILE . . . . . 0.525 ' CG2' ' N ' ' B' ' 222' ' ' TYR . 3.8 tp -64.94 -45.76 93.77 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 C-N-CA 120.571 -0.452 . . . . 0.0 111.11 -179.174 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 222' ' ' TYR . . . . . 0.525 ' N ' ' CG2' ' B' ' 221' ' ' ILE . 90.4 t80 -62.36 -43.75 98.09 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.547 -179.46 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 223' ' ' HIS . . . . . . . . . . . . . 2.9 m-70 -67.47 -41.45 84.58 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.7 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 6.2 t -68.02 -44.5 76.37 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.915 0.388 . . . . 0.0 110.834 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 15.3 tm-20 -67.81 -28.78 67.87 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.664 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 15.7 t60 . . . . . 0 N--CA 1.454 -0.253 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.263 -178.987 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . 0.448 ' OD1' ' N ' ' A' ' 16' ' ' ASP . 22.8 p-10 . . . . . 0 N--CA 1.464 0.254 0 CA-C-O 120.948 0.404 . . . . 0.0 110.673 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 78.3 p -54.74 -49.69 70.19 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.299 178.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 11.1 tp-100 -62.44 -45.1 94.59 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.308 -0.405 . . . . 0.0 109.909 179.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -57.14 -29.41 63.56 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.377 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -72.72 -51.73 18.04 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 121.201 0.524 . . . . 0.0 110.416 179.547 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.2 -41.08 97.23 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.954 179.76 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 59.4 tt0 -64.92 -53.3 48.68 Favored 'General case' 0 C--O 1.241 0.654 0 CA-C-O 121.279 0.561 . . . . 0.0 110.902 -179.412 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 96.6 t -61.56 -44.29 98.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.183 179.633 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -54.71 -42.53 71.61 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 179.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.6 t -58.81 -44.77 90.89 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 179.736 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 12.0 m -63.3 -45.73 90.0 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.26 179.024 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 95.7 mt -64.85 -22.28 66.96 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.523 179.717 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -74.77 -55.66 5.6 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.425 179.49 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.66 -55.58 33.31 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.375 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.509 ' O ' ' O ' ' A' ' 31' ' ' ALA . 89.9 mt -44.94 -34.64 2.49 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.312 -179.565 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.509 ' O ' ' O ' ' A' ' 30' ' ' LEU . . . -56.41 -139.97 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 O-C-N 123.517 0.511 . . . . 0.0 110.568 179.152 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.456 ' O ' ' O ' ' A' ' 31' ' ' ALA . 85.4 m 57.23 115.3 0.02 OUTLIER Pre-proline 0 C--N 1.323 -0.575 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.547 179.784 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -49.55 -46.76 25.41 Favored 'Trans proline' 0 N--CA 1.493 1.465 0 C-N-CA 122.371 2.047 . . . . 0.0 112.722 -179.337 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 57.9 m -62.87 -46.82 86.05 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.307 -178.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.2 tpp180 -63.01 -47.62 82.3 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.448 -178.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 3.2 tt -60.38 -53.27 59.56 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.439 -178.636 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 62.1 ttp -50.77 -48.3 59.37 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-O 120.909 0.385 . . . . 0.0 110.167 179.776 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 5.5 mm -62.26 -43.83 98.44 Favored 'Isoleucine or valine' 0 C--O 1.239 0.519 0 CA-C-O 121.091 0.472 . . . . 0.0 110.525 179.501 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 14.3 mt -61.79 -41.11 97.32 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.288 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 9.8 m -58.36 -40.44 82.26 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.01 -0.541 . . . . 0.0 109.672 179.539 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.401 HE22 HD13 ' A' ' 56' ' ' ILE . 51.6 mt-30 -61.85 -44.28 97.15 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.469 179.499 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.517 ' O ' ' N ' ' A' ' 44' ' ' ASN . 80.5 mt -63.46 -31.57 72.76 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.127 179.472 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.526 HH21 ' CG ' ' A' ' 99' ' ' ASP . 33.4 tpt85 -33.9 -32.5 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 O-C-N 123.534 0.521 . . . . 0.0 110.866 -179.593 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.517 ' N ' ' O ' ' A' ' 42' ' ' LEU . 81.2 m-20 -72.44 -84.22 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.43 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 149.73 -76.37 0.24 Allowed Glycine 0 CA--C 1.527 0.82 0 N-CA-C 110.882 -0.887 . . . . 0.0 110.882 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -68.71 84.25 0.51 Allowed 'Trans proline' 0 C--N 1.307 -1.652 0 C-N-CA 122.742 2.294 . . . . 0.0 112.328 -179.379 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -156.9 68.07 4.33 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-O 121.045 0.45 . . . . 0.0 110.108 -179.747 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_exo -45.07 170.52 0.02 OUTLIER 'Trans proline' 0 C--N 1.298 -2.107 0 C-N-CA 122.416 2.078 . . . . 0.0 112.168 -179.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 80.8 t -54.32 -45.44 68.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.335 -179.593 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 15.1 m -61.34 -39.23 89.8 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.16 0.505 . . . . 0.0 110.292 179.117 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -66.31 -41.29 89.9 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.106 179.686 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.77 -42.58 99.17 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.775 -179.764 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.577 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -56.37 -47.78 78.19 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 179.323 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -54.64 -45.27 73.75 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.686 -0.406 . . . . 0.0 109.939 179.639 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -55.52 -57.59 11.27 Favored 'General case' 0 C--N 1.333 -0.139 0 C-N-CA 120.763 -0.375 . . . . 0.0 110.649 179.687 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.407 HG23 HD11 ' A' ' 56' ' ' ILE . 95.3 mt -80.48 -69.11 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.389 179.36 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . 0.577 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 131.95 75.93 0.12 Allowed Glycine 0 CA--C 1.521 0.438 0 N-CA-C 110.931 -0.868 . . . . 0.0 110.931 179.817 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.438 ' CB ' ' O ' ' A' ' 57' ' ' GLY . 1.1 tmm? 77.72 95.91 0.06 Allowed 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.708 179.581 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 19.9 tp10 -174.06 34.25 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.18 179.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -69.63 -20.91 63.59 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.957 -179.291 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 77.9 p -69.17 -43.55 74.03 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.958 -179.679 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.25 -35.79 81.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.266 179.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 87.0 t -66.97 -51.84 50.35 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.232 0 C-N-CA 120.727 -0.389 . . . . 0.0 110.433 -179.729 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 51.7 m -55.24 -44.04 75.14 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.53 -0.468 . . . . 0.0 110.358 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 76.1 m-70 -68.42 -44.1 75.73 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.033 179.733 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 64.9 mt-30 -60.77 -40.62 93.18 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.381 -179.693 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -68.06 -39.85 82.88 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 120.975 0.417 . . . . 0.0 110.561 179.141 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.514 ' NH1' HD22 ' A' ' 72' ' ' ASN . 17.5 tpt85 -58.81 -47.19 85.64 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.617 -178.916 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.444 ' CG2' ' H ' ' A' ' 70' ' ' LEU . 27.6 m -75.24 -53.05 17.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.525 179.902 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.444 ' H ' ' CG2' ' A' ' 69' ' ' VAL . 69.5 mt -52.94 -38.97 62.5 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 -179.612 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 78.4 ttt180 -68.45 -42.37 78.91 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.481 178.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . 0.514 HD22 ' NH1' ' A' ' 68' ' ' ARG . 99.1 m-20 -60.08 -52.41 65.47 Favored 'General case' 0 C--N 1.333 -0.126 0 C-N-CA 120.646 -0.422 . . . . 0.0 110.426 -179.476 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.496 ' CD2' ' N ' ' A' ' 73' ' ' LEU . 3.9 mm? -67.28 -39.95 86.09 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.679 178.954 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 96.61 98.55 1.89 Allowed Glycine 0 CA--C 1.523 0.575 0 N-CA-C 110.938 -0.865 . . . . 0.0 110.938 -179.493 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.9 tp -163.05 -7.39 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.816 0.341 . . . . 0.0 110.76 179.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 33.6 m -140.61 163.37 22.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.271 -179.867 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 37.1 t -139.96 154.39 23.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.443 179.796 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -143.45 152.2 23.91 Favored Glycine 0 CA--C 1.522 0.486 0 N-CA-C 110.802 -0.919 . . . . 0.0 110.802 179.323 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . 0.452 ' OD1' ' N ' ' A' ' 79' ' ' ASP . 3.9 p-10 . . . . . 0 N--CA 1.465 0.324 0 CA-C-O 120.667 0.27 . . . . 0.0 110.327 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 48.0 t . . . . . 0 N--CA 1.464 0.225 0 CA-C-O 120.858 0.361 . . . . 0.0 111.066 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 8.6 m-85 -108.27 126.08 52.41 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.076 178.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 38.6 m -148.65 166.72 27.49 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.365 -179.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 10.8 mt -61.65 152.42 30.85 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.272 -179.464 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 6.9 t80 -54.6 -49.43 70.48 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.43 -179.349 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 81.5 m-20 -130.99 -180.0 5.66 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 121.018 0.437 . . . . 0.0 110.373 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 19.1 m -95.37 -18.15 20.99 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.44 -179.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . 0.507 ' CG ' ' ND1' ' B' ' 223' ' ' HIS . 84.3 m-70 -43.46 -63.85 0.75 Allowed 'General case' 0 C--O 1.236 0.373 0 CA-C-O 120.978 0.418 . . . . 0.0 110.413 179.775 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 29.5 m -48.7 -35.02 6.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.189 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.41 -37.65 88.25 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.231 179.317 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.423 ' O ' ' OE2' ' A' ' 100' ' ' GLU . 99.1 mm-40 -63.17 -46.11 88.69 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 116.159 -0.473 . . . . 0.0 109.99 -179.894 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 9.0 mp -61.7 -43.52 98.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.133 -179.705 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 38.1 tp -65.47 -36.92 85.31 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.322 179.622 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . 0.526 ' CG ' HH21 ' A' ' 43' ' ' ARG . 94.7 m-20 -60.1 -45.5 92.75 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.113 -0.494 . . . . 0.0 109.895 -179.527 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.528 ' N ' ' OE1' ' A' ' 100' ' ' GLU . 0.4 OUTLIER -65.41 -53.24 45.95 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.284 -0.416 . . . . 0.0 109.997 179.586 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -53.24 -43.51 67.39 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.559 -0.456 . . . . 0.0 110.221 179.41 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 3.7 mm -60.59 -47.9 90.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 C-N-CA 120.369 -0.532 . . . . 0.0 110.516 -178.82 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -63.02 -40.12 96.81 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.391 -179.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' HIS . . . . . 0.443 ' ND1' ' CG ' ' B' ' 212' ' ' HIS . 81.3 t60 -60.21 -47.15 87.16 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.744 -179.65 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 11.0 t -74.34 -38.56 63.22 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.107 0.48 . . . . 0.0 111.222 179.76 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 81.9 tt0 -59.15 -39.09 81.32 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.793 -179.069 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 57.3 t-80 . . . . . 0 N--CA 1.454 -0.242 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.215 -179.343 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 135' ' ' ASP . . . . . 0.481 ' N ' ' OD1' ' B' ' 135' ' ' ASP . 26.5 p-10 . . . . . 0 N--CA 1.464 0.226 0 CA-C-O 120.929 0.395 . . . . 0.0 110.841 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 89.8 p -52.98 -50.59 63.84 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.293 179.098 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 11.2 tp-100 -61.5 -44.22 97.47 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 109.851 -0.425 . . . . 0.0 109.851 179.786 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 138' ' ' ALA . . . . . . . . . . . . . . . -58.14 -29.24 65.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.23 179.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -72.57 -52.45 15.48 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 121.032 0.444 . . . . 0.0 110.395 179.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -64.75 -40.25 94.98 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.95 179.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 59.0 tt0 -64.6 -53.18 51.78 Favored 'General case' 0 C--O 1.241 0.642 0 CA-C-O 121.349 0.595 . . . . 0.0 110.859 -179.6 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 142' ' ' VAL . . . . . . . . . . . . . 96.8 t -62.76 -44.49 99.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.051 179.645 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -53.72 -43.97 69.46 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 179.717 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 14.8 t -57.99 -44.42 87.13 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 179.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 9.9 m -63.2 -45.64 90.74 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.102 178.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 96.2 mt -64.32 -22.56 66.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.524 179.583 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 147' ' ' GLN . . . . . . . . . . . . . 55.1 tt0 -75.02 -55.71 5.47 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.289 179.357 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -58.09 -55.58 33.16 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.371 -179.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.505 ' O ' ' O ' ' B' ' 150' ' ' ALA . 93.6 mt -45.41 -35.88 3.96 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.342 -179.557 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 150' ' ' ALA . . . . . 0.505 ' O ' ' O ' ' B' ' 149' ' ' LEU . . . -56.45 -139.76 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 O-C-N 123.56 0.537 . . . . 0.0 110.518 179.5 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 151' ' ' THR . . . . . 0.449 ' O ' ' O ' ' B' ' 150' ' ' ALA . 95.7 m 57.37 114.49 0.02 OUTLIER Pre-proline 0 C--N 1.323 -0.558 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.293 179.947 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -48.99 -47.76 20.52 Favored 'Trans proline' 0 N--CA 1.493 1.474 0 C-N-CA 122.292 1.995 . . . . 0.0 112.819 -179.042 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 67.9 m -61.91 -46.78 87.88 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.29 -179.022 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 3.2 tpp180 -62.61 -47.37 84.06 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.403 -178.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 155' ' ' LEU . . . . . . . . . . . . . 2.7 tt -60.74 -52.96 62.88 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.43 -178.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 63.0 ttp -50.42 -48.06 56.33 Favored 'General case' 0 C--O 1.238 0.488 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.243 179.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 5.9 mm -62.71 -44.0 99.11 Favored 'Isoleucine or valine' 0 C--O 1.238 0.497 0 CA-C-O 121.019 0.437 . . . . 0.0 110.623 179.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 63.3 mt -61.73 -41.7 97.99 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.532 179.541 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 9.9 m -58.0 -40.05 79.8 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.71 179.572 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 160' ' ' GLN . . . . . 0.402 HE22 HD13 ' B' ' 175' ' ' ILE . 49.9 mt-30 -63.05 -44.35 96.08 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.826 -0.35 . . . . 0.0 110.421 179.417 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 161' ' ' LEU . . . . . 0.466 ' O ' ' N ' ' B' ' 163' ' ' ASN . 76.7 mt -62.83 -31.76 72.83 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.142 179.502 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 162' ' ' ARG . . . . . 0.504 HH21 ' CG ' ' B' ' 218' ' ' ASP . 33.4 tpt85 -34.58 -33.69 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 O-C-N 123.548 0.53 . . . . 0.0 110.959 -179.612 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 163' ' ' ASN . . . . . 0.466 ' N ' ' O ' ' B' ' 161' ' ' LEU . 86.9 m-20 -70.13 -83.0 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.293 179.671 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . 147.92 -76.05 0.26 Allowed Glycine 0 CA--C 1.525 0.675 0 N-CA-C 110.933 -0.867 . . . . 0.0 110.933 179.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -68.36 84.41 0.47 Allowed 'Trans proline' 0 N--CA 1.496 1.62 0 C-N-CA 122.71 2.274 . . . . 0.0 112.298 -179.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -157.02 66.72 3.99 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.101 0.477 . . . . 0.0 110.169 -179.552 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -44.51 171.36 0.02 OUTLIER 'Trans proline' 0 C--N 1.299 -2.053 0 C-N-CA 122.452 2.101 . . . . 0.0 112.143 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . 83.0 t -54.26 -46.57 68.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.324 -179.409 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 169' ' ' THR . . . . . . . . . . . . . 12.6 m -61.6 -37.81 85.29 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.274 0.559 . . . . 0.0 110.417 179.272 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -67.01 -40.55 87.32 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.133 179.78 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.73 -42.07 99.49 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.9 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 172' ' ' ALA . . . . . 0.575 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -56.54 -48.47 77.22 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 179.406 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -54.56 -43.95 72.48 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.013 179.592 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -56.95 -55.85 29.29 Favored 'General case' 0 C--O 1.232 0.154 0 C-N-CA 120.696 -0.402 . . . . 0.0 110.687 179.698 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 175' ' ' ILE . . . . . 0.402 HD13 HE22 ' B' ' 160' ' ' GLN . 89.7 mt -81.97 -68.66 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.299 179.497 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 176' ' ' GLY . . . . . 0.575 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 132.33 72.71 0.1 OUTLIER Glycine 0 CA--C 1.52 0.37 0 N-CA-C 110.962 -0.855 . . . . 0.0 110.962 179.742 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 177' ' ' MET . . . . . 0.474 ' CB ' ' O ' ' B' ' 176' ' ' GLY . 1.2 tmm? 79.86 96.47 0.06 Allowed 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 120.914 -0.314 . . . . 0.0 110.794 179.517 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -174.5 34.18 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.202 179.799 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -68.54 -23.29 64.51 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.899 -179.484 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 69.8 p -66.45 -44.88 81.6 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.055 -179.75 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -62.59 -34.99 78.11 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.382 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 97.9 t -66.98 -52.34 45.01 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.225 0 C-N-CA 120.602 -0.439 . . . . 0.0 110.509 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 50.0 m -55.21 -43.89 74.85 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.57 -0.452 . . . . 0.0 110.455 -179.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 77.7 m-70 -67.78 -42.91 80.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.034 179.756 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 69.7 mt-30 -62.74 -39.97 95.77 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.338 -179.848 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -67.93 -40.59 83.3 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 120.993 0.425 . . . . 0.0 110.592 178.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 187' ' ' ARG . . . . . 0.606 ' NH1' HD22 ' B' ' 191' ' ' ASN . 16.8 tpt85 -58.65 -46.31 87.41 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.712 -178.737 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 188' ' ' VAL . . . . . 0.422 ' CG2' ' H ' ' B' ' 189' ' ' LEU . 29.4 m -75.85 -52.59 17.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.537 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 189' ' ' LEU . . . . . 0.422 ' H ' ' CG2' ' B' ' 188' ' ' VAL . 72.1 mt -53.53 -39.91 65.07 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.161 -0.472 . . . . 0.0 109.746 -179.793 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 77.3 ttt180 -67.16 -43.18 82.93 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.453 179.038 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 191' ' ' ASN . . . . . 0.606 HD22 ' NH1' ' B' ' 187' ' ' ARG . 93.8 m-20 -59.35 -51.66 68.95 Favored 'General case' 0 C--O 1.23 0.071 0 C-N-CA 120.553 -0.459 . . . . 0.0 110.395 -179.407 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 192' ' ' LEU . . . . . 0.473 ' CD2' ' N ' ' B' ' 192' ' ' LEU . 4.1 mm? -68.12 -39.34 82.79 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.83 178.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 96.05 97.89 1.81 Allowed Glycine 0 CA--C 1.522 0.522 0 N-CA-C 110.915 -0.874 . . . . 0.0 110.915 -179.58 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 4.2 tp -162.19 -9.0 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.904 0.383 . . . . 0.0 110.716 179.791 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 34.4 m -139.42 161.65 27.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.382 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 196' ' ' VAL . . . . . 0.402 ' CG1' ' N ' ' B' ' 197' ' ' GLY . 41.1 t -139.8 154.52 24.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 121.043 0.449 . . . . 0.0 110.473 179.892 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 197' ' ' GLY . . . . . 0.402 ' N ' ' CG1' ' B' ' 196' ' ' VAL . . . -143.21 153.09 24.56 Favored Glycine 0 CA--C 1.519 0.334 0 N-CA-C 111.002 -0.839 . . . . 0.0 111.002 179.505 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 198' ' ' ASP . . . . . 0.434 ' N ' ' OD1' ' B' ' 198' ' ' ASP . 5.8 p-10 . . . . . 0 N--CA 1.464 0.247 0 CA-C-O 120.83 0.348 . . . . 0.0 110.456 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 58.8 t . . . . . 0 N--CA 1.463 0.187 0 CA-C-O 120.979 0.419 . . . . 0.0 110.686 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -107.24 129.81 54.82 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.655 179.207 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 49.2 m -150.59 168.56 23.9 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.361 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . 18.1 mt -63.21 152.12 38.45 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.376 -179.65 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -55.04 -48.71 73.07 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.368 -179.343 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 84.3 m-20 -132.88 177.84 7.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.936 0.398 . . . . 0.0 110.402 -179.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 24.3 m -92.83 -20.02 21.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.457 -179.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 212' ' ' HIS . . . . . 0.443 ' CG ' ' ND1' ' A' ' 104' ' ' HIS . 83.7 m-70 -41.24 -65.44 0.43 Allowed 'General case' 0 C--O 1.237 0.429 0 CA-C-O 120.912 0.387 . . . . 0.0 110.557 179.876 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 22.8 m -47.88 -34.06 4.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.199 179.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 214' ' ' ALA . . . . . . . . . . . . . . . -65.04 -38.34 90.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.255 179.205 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 215' ' ' GLN . . . . . 0.412 ' O ' ' OE2' ' B' ' 219' ' ' GLU . 99.4 mm-40 -62.09 -46.99 86.64 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 121.056 0.455 . . . . 0.0 110.095 -179.908 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 216' ' ' LEU . . . . . . . . . . . . . 8.0 mp -61.01 -42.64 98.84 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.27 -180.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 45.7 tp -65.86 -37.34 85.93 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.383 179.523 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 218' ' ' ASP . . . . . 0.504 ' CG ' HH21 ' B' ' 162' ' ' ARG . 99.5 m-20 -59.9 -43.8 94.63 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.17 -0.468 . . . . 0.0 109.957 -179.469 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 219' ' ' GLU . . . . . 0.497 ' OE1' ' N ' ' B' ' 219' ' ' GLU . 0.6 OUTLIER -67.94 -52.12 39.74 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.15 179.344 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -53.22 -44.22 67.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.166 179.477 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 4.9 mm -61.61 -45.9 97.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 C-N-CA 120.312 -0.555 . . . . 0.0 110.876 -179.34 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -63.36 -39.82 95.57 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.499 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 223' ' ' HIS . . . . . 0.507 ' ND1' ' CG ' ' A' ' 93' ' ' HIS . 81.5 t60 -60.85 -46.77 89.28 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.728 -179.832 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 10.5 t -73.91 -39.81 63.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.156 179.65 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -56.94 -40.19 75.92 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.653 -179.252 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 53.2 t-80 . . . . . 0 N--CA 1.455 -0.216 0 C-N-CA 120.568 -0.453 . . . . 0.0 110.338 -179.181 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 . . . . . 0 C--O 1.236 0.389 0 CA-C-O 121.294 0.568 . . . . 0.0 110.994 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 93.4 p -58.77 -33.67 70.57 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.279 -179.424 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 54.3 mt-30 -68.59 -48.22 64.73 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.439 179.52 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -55.68 -38.42 69.6 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 -179.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.64 -53.13 45.68 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 120.996 0.427 . . . . 0.0 110.259 179.606 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.98 -43.37 95.16 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 120.702 -0.399 . . . . 0.0 110.842 -179.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -64.17 -53.13 54.28 Favored 'General case' 0 C--O 1.242 0.665 0 CA-C-O 121.394 0.616 . . . . 0.0 111.045 -179.463 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.478 ' O ' ' OG1' ' A' ' 26' ' ' THR . 96.0 t -61.73 -45.48 98.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.183 179.801 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.13 -41.3 83.39 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 179.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 45.6 t -57.08 -45.33 83.42 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 -179.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.478 ' OG1' ' O ' ' A' ' 23' ' ' VAL . 20.8 p -65.56 -44.68 86.02 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 120.755 -0.378 . . . . 0.0 110.497 178.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 96.1 mt -64.42 -23.72 67.38 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.661 179.482 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 57.0 tt0 -75.14 -57.38 3.93 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.54 179.543 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.26 -54.55 45.77 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 120.61 -0.436 . . . . 0.0 110.466 -179.417 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.489 ' O ' ' O ' ' A' ' 31' ' ' ALA . 88.7 mt -46.08 -34.62 4.27 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.27 -179.55 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.489 ' O ' ' O ' ' A' ' 30' ' ' LEU . . . -57.03 -129.44 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 O-C-N 123.642 0.589 . . . . 0.0 110.364 179.437 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.46 ' O ' ' O ' ' A' ' 31' ' ' ALA . 0.3 OUTLIER 52.8 108.31 0.02 OUTLIER Pre-proline 0 CA--C 1.54 0.572 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.331 179.561 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_exo -45.8 -59.91 1.03 Allowed 'Trans proline' 0 C--N 1.309 -1.523 0 C-N-CA 122.166 1.91 . . . . 0.0 112.882 -179.217 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 50.8 m -54.86 -45.7 74.61 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.869 -178.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 46.0 mmm-85 -61.79 -44.76 96.23 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.027 -179.582 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 2.0 tt -63.11 -49.0 76.16 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.423 -179.342 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 28.6 ttt -52.1 -48.53 64.72 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.242 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.408 HG23 HD11 ' A' ' 38' ' ' ILE . 38.2 mm -63.63 -43.4 98.14 Favored 'Isoleucine or valine' 0 C--O 1.244 0.801 0 CA-C-O 121.189 0.519 . . . . 0.0 110.574 179.542 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 15.7 tp -61.76 -41.28 97.48 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.225 -179.55 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 19.6 m -61.27 -42.41 98.58 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 179.364 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 10.6 tp-100 -54.34 -48.06 71.84 Favored 'General case' 0 C--O 1.233 0.19 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 17.2 mt -64.29 -40.15 95.38 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.509 -0.476 . . . . 0.0 111.087 178.774 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 30.1 ttm180 -46.03 -25.51 0.58 Allowed 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.35 -179.186 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -61.59 -39.84 92.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.582 -179.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 157.66 -176.89 34.67 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.911 -0.876 . . . . 0.0 110.911 179.846 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -78.35 117.9 4.17 Favored 'Trans proline' 0 C--N 1.309 -1.501 0 C-N-CA 122.885 2.39 . . . . 0.0 111.67 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -148.75 128.25 6.39 Favored Pre-proline 0 CA--C 1.543 0.693 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.368 -179.58 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -47.53 167.28 0.09 OUTLIER 'Trans proline' 0 C--N 1.307 -1.613 0 C-N-CA 122.266 1.978 . . . . 0.0 112.475 178.745 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.424 ' CG2' ' N ' ' A' ' 50' ' ' THR . 2.4 m -61.06 -37.36 77.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-O 121.586 0.708 . . . . 0.0 110.518 179.91 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.424 ' N ' ' CG2' ' A' ' 49' ' ' VAL . 26.9 m -59.99 -44.93 94.19 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 115.029 -0.987 . . . . 0.0 110.386 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 55.4 m-20 -66.21 -39.33 89.55 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.122 178.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.8 tt -61.55 -42.51 98.94 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.795 -179.886 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.563 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -60.75 -43.85 97.45 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 179.719 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -55.14 -44.79 75.4 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.63 -0.428 . . . . 0.0 109.878 179.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -62.53 -39.67 94.33 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.731 -0.388 . . . . 0.0 110.602 179.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 90.9 mt -94.38 -78.08 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.239 179.577 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . 0.563 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 150.11 83.55 0.04 OUTLIER Glycine 0 CA--C 1.521 0.408 0 N-CA-C 111.663 -0.575 . . . . 0.0 111.663 179.622 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.407 ' O ' ' OE1' ' A' ' 59' ' ' GLU . 87.1 mtp 57.49 103.32 0.02 OUTLIER 'General case' 0 CA--C 1.518 -0.283 0 CA-C-O 121.015 0.436 . . . . 0.0 111.047 179.008 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.407 ' OE1' ' O ' ' A' ' 58' ' ' MET . 3.6 tp10 -174.86 32.74 0.01 OUTLIER 'General case' 0 N--CA 1.456 -0.132 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.298 179.78 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 -63.1 -23.85 67.63 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.057 -178.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.443 ' HG ' ' H ' ' A' ' 62' ' ' ALA . 78.0 p -71.06 -43.73 67.19 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.087 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.443 ' H ' ' HG ' ' A' ' 61' ' ' SER . . . -64.07 -29.7 70.82 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.174 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 92.4 t -74.45 -52.07 20.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 C-N-CA 120.809 -0.356 . . . . 0.0 110.615 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 67.9 p -56.03 -45.43 79.16 Favored 'General case' 0 C--O 1.233 0.192 0 C-N-CA 120.533 -0.467 . . . . 0.0 110.651 -179.77 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 73.6 m-70 -66.25 -50.9 62.17 Favored 'General case' 0 C--O 1.242 0.662 0 CA-C-O 121.171 0.51 . . . . 0.0 111.235 -179.866 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 79.9 mt-30 -58.34 -31.56 67.69 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.245 179.458 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.416 ' O ' ' CG ' ' A' ' 71' ' ' ARG . 5.1 tp -69.65 -43.39 72.71 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.446 179.931 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 82.3 mtp180 -60.19 -49.75 76.4 Favored 'General case' 0 C--O 1.245 0.843 0 CA-C-O 121.512 0.673 . . . . 0.0 111.167 -179.298 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.447 ' CG1' ' H ' ' A' ' 70' ' ' LEU . 4.4 p -66.2 -54.55 25.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.349 179.523 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.447 ' H ' ' CG1' ' A' ' 69' ' ' VAL . 70.8 mt -54.17 -35.23 62.07 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 -179.65 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.416 ' CG ' ' O ' ' A' ' 67' ' ' LEU . 11.9 mmm180 -61.78 -40.46 95.29 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.651 179.148 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -62.78 -42.97 99.93 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.075 -179.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 6.9 mt -67.61 -42.34 82.57 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.422 -179.496 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 100.9 37.54 3.63 Favored Glycine 0 CA--C 1.522 0.483 0 N-CA-C 111.22 -0.752 . . . . 0.0 111.22 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -100.43 -15.37 17.95 Favored 'General case' 0 CA--C 1.512 -0.483 0 O-C-N 122.825 -0.221 . . . . 0.0 110.897 179.534 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 23.2 m -136.57 158.58 37.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-O 120.846 0.355 . . . . 0.0 110.049 -179.815 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.432 ' CG1' ' N ' ' A' ' 78' ' ' GLY . 40.1 t -142.48 156.53 18.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.622 179.836 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . 0.432 ' N ' ' CG1' ' A' ' 77' ' ' VAL . . . -105.13 167.68 15.18 Favored Glycine 0 CA--C 1.522 0.524 0 N-CA-C 110.309 -1.116 . . . . 0.0 110.309 179.555 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 68.0 t0 . . . . . 0 C--N 1.329 -0.289 0 CA-C-O 120.602 0.239 . . . . 0.0 110.568 -179.374 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 18.6 t . . . . . 0 C--O 1.224 -0.262 0 CA-C-O 120.732 0.301 . . . . 0.0 110.403 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 44.2 m-85 -106.0 136.64 45.3 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.532 -179.496 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 94.8 p -151.91 172.7 15.82 Favored 'General case' 0 C--O 1.224 -0.289 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.423 -179.798 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 56.3 mt -65.41 148.2 52.12 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.656 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 10.2 t80 -52.71 -48.5 66.59 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.312 -179.456 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 46.5 p-10 -146.77 -179.78 7.03 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.781 0.324 . . . . 0.0 110.555 -179.857 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 42.0 p -88.7 -16.34 32.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.558 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 58.4 m80 -46.88 -65.38 0.57 Allowed 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.048 0.452 . . . . 0.0 110.697 -179.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 11.9 p -52.79 -35.25 21.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.193 -179.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.97 -40.35 97.44 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.411 179.493 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -63.55 -44.45 94.12 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 116.013 -0.54 . . . . 0.0 109.895 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 13.9 tp -60.02 -42.71 94.94 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.158 -179.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 87.5 mt -63.39 -39.2 93.87 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.154 179.801 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -60.28 -42.86 96.33 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.103 -179.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 73.8 mm-40 -67.72 -47.69 68.64 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.542 179.617 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.14 -44.29 92.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.262 -0.426 . . . . 0.0 109.949 179.684 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 5.0 mm -62.94 -44.13 99.43 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.639 -179.561 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -60.08 -42.19 94.07 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.998 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 35.0 m170 -68.77 -35.96 77.72 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.245 179.788 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 7.0 t -59.02 -47.98 83.25 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.322 -179.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -74.8 -57.28 4.01 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.003 0.43 . . . . 0.0 110.431 179.465 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 53.3 m170 . . . . . 0 C--N 1.331 -0.229 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.043 -179.867 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 . . . . . 0 N--CA 1.466 0.37 0 CA-C-O 120.963 0.411 . . . . 0.0 110.591 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 11.2 t -59.14 -48.79 80.32 Favored 'General case' 0 C--O 1.24 0.585 0 CA-C-O 121.189 0.519 . . . . 0.0 110.711 178.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 73.8 mt-30 -64.53 -42.78 95.55 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.948 -179.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 138' ' ' ALA . . . . . . . . . . . . . . . -55.83 -38.86 70.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.08 -179.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -65.36 -53.25 46.25 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 120.933 0.396 . . . . 0.0 110.242 179.552 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -60.52 -41.85 95.22 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.532 -0.467 . . . . 0.0 110.879 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 59.5 tt0 -64.35 -53.71 44.43 Favored 'General case' 0 C--O 1.244 0.773 0 CA-C-O 121.415 0.626 . . . . 0.0 111.025 -179.573 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 142' ' ' VAL . . . . . 0.488 ' O ' ' OG1' ' B' ' 145' ' ' THR . 89.4 t -62.17 -45.68 98.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.006 179.684 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -57.27 -42.09 80.97 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 44.2 t -56.58 -45.84 81.11 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 -179.725 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 145' ' ' THR . . . . . 0.488 ' OG1' ' O ' ' B' ' 142' ' ' VAL . 21.7 p -65.16 -44.02 89.89 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 120.65 -0.42 . . . . 0.0 110.54 179.078 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 95.9 mt -64.37 -24.05 67.5 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.598 179.455 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 147' ' ' GLN . . . . . . . . . . . . . 55.9 tt0 -75.38 -57.05 4.13 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.536 179.607 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -57.95 -54.67 44.32 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.599 -179.32 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.501 ' O ' ' O ' ' B' ' 150' ' ' ALA . 92.9 mt -46.29 -35.56 5.43 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.319 -179.66 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 150' ' ' ALA . . . . . 0.501 ' O ' ' O ' ' B' ' 149' ' ' LEU . . . -56.69 -131.43 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.262 0.553 . . . . 0.0 110.407 179.6 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 151' ' ' THR . . . . . 0.454 ' O ' ' O ' ' B' ' 150' ' ' ALA . 0.4 OUTLIER 54.61 108.61 0.02 OUTLIER Pre-proline 0 CA--C 1.539 0.539 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.322 179.503 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -45.58 -61.45 0.59 Allowed 'Trans proline' 0 C--N 1.31 -1.494 0 C-N-CA 122.304 2.003 . . . . 0.0 112.868 -179.11 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 49.6 m -53.96 -46.7 71.69 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.0 -178.591 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 46.0 mmm-85 -60.46 -44.09 96.23 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 120.716 -0.394 . . . . 0.0 111.011 -179.502 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 155' ' ' LEU . . . . . . . . . . . . . 1.9 tt -64.18 -49.16 73.14 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.31 -179.389 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 28.6 ttt -51.61 -49.05 62.93 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.241 -179.459 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 42.8 mm -64.24 -43.69 97.3 Favored 'Isoleucine or valine' 0 C--O 1.247 0.931 0 CA-C-O 121.188 0.518 . . . . 0.0 110.437 179.737 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 17.6 tp -60.84 -42.1 97.11 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.262 -179.516 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 19.0 m -61.57 -41.59 97.62 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.858 179.383 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 10.4 tp-100 -53.45 -49.29 67.7 Favored 'General case' 0 C--O 1.233 0.202 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 161' ' ' LEU . . . . . 0.464 ' O ' ' N ' ' B' ' 163' ' ' ASN . 8.9 mt -64.29 -40.65 96.39 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.288 -0.565 . . . . 0.0 111.153 179.054 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 162' ' ' ARG . . . . . . . . . . . . . 32.6 ttm180 -42.14 -23.56 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.287 -179.213 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 163' ' ' ASN . . . . . 0.464 ' N ' ' O ' ' B' ' 161' ' ' LEU . 7.7 m120 -63.06 -41.46 99.46 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.624 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 164' ' ' GLY . . . . . 0.401 ' N ' ' O ' ' B' ' 161' ' ' LEU . . . 155.83 -170.36 33.65 Favored Glycine 0 CA--C 1.522 0.484 0 N-CA-C 111.09 -0.804 . . . . 0.0 111.09 179.523 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -74.24 120.27 6.2 Favored 'Trans proline' 0 N--CA 1.495 1.594 0 C-N-CA 122.916 2.411 . . . . 0.0 111.849 179.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -151.92 120.91 3.39 Favored Pre-proline 0 CA--C 1.545 0.768 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.633 179.843 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -47.6 168.67 0.07 OUTLIER 'Trans proline' 0 C--N 1.304 -1.788 0 C-N-CA 122.26 1.974 . . . . 0.0 112.317 178.633 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 168' ' ' VAL . . . . . 0.42 ' CG2' ' N ' ' B' ' 169' ' ' THR . 2.6 m -60.46 -37.75 75.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-O 121.698 0.761 . . . . 0.0 110.41 179.875 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 169' ' ' THR . . . . . 0.42 ' N ' ' CG2' ' B' ' 168' ' ' VAL . 14.0 m -60.7 -45.65 93.37 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 115.058 -0.973 . . . . 0.0 110.192 -179.944 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 71.5 m-20 -65.11 -41.15 95.17 Favored 'General case' 0 C--O 1.241 0.639 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.077 179.314 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 4.5 tt -61.32 -41.71 97.46 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.936 -179.541 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 172' ' ' ALA . . . . . 0.549 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -60.77 -44.03 97.28 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 179.649 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -55.26 -44.52 75.66 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.275 -0.42 . . . . 0.0 109.897 179.773 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -61.92 -41.04 97.47 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.47 179.623 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 96.7 mt -93.52 -79.04 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.183 179.486 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 176' ' ' GLY . . . . . 0.549 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 151.84 82.43 0.04 OUTLIER Glycine 0 CA--C 1.52 0.388 0 N-CA-C 111.518 -0.633 . . . . 0.0 111.518 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 177' ' ' MET . . . . . 0.435 ' O ' ' OE1' ' B' ' 178' ' ' GLU . 89.0 mtp 58.34 105.37 0.02 OUTLIER 'General case' 0 CA--C 1.518 -0.253 0 CA-C-O 120.853 0.359 . . . . 0.0 110.995 179.076 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 178' ' ' GLU . . . . . 0.435 ' OE1' ' O ' ' B' ' 177' ' ' MET . 4.0 tp10 -176.87 32.75 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.28 179.75 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 7.5 mt-30 -62.84 -23.8 67.46 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.031 -179.005 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 180' ' ' SER . . . . . 0.431 ' HG ' ' N ' ' B' ' 181' ' ' ALA . 78.7 p -70.95 -42.45 69.79 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.968 -179.697 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 181' ' ' ALA . . . . . 0.431 ' N ' ' HG ' ' B' ' 180' ' ' SER . . . -65.71 -28.91 69.4 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.299 -179.898 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 97.9 t -74.8 -52.47 19.14 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.126 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.547 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 79.4 p -56.32 -43.8 79.34 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 120.541 -0.464 . . . . 0.0 110.366 -179.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 64.5 m-70 -66.84 -50.93 60.99 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-O 121.163 0.506 . . . . 0.0 111.078 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -58.8 -31.48 68.46 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.214 179.507 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 186' ' ' LEU . . . . . 0.415 ' O ' ' CG ' ' B' ' 190' ' ' ARG . 5.1 tp -69.77 -43.46 72.15 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.549 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 81.3 mtp180 -60.02 -49.17 78.71 Favored 'General case' 0 C--O 1.246 0.876 0 CA-C-O 121.293 0.568 . . . . 0.0 111.144 -179.376 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 188' ' ' VAL . . . . . 0.447 ' CG1' ' H ' ' B' ' 189' ' ' LEU . 4.9 p -67.05 -54.39 24.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.243 179.726 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 189' ' ' LEU . . . . . 0.447 ' H ' ' CG1' ' B' ' 188' ' ' VAL . 73.4 mt -54.21 -35.63 62.6 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 -179.657 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 190' ' ' ARG . . . . . 0.415 ' CG ' ' O ' ' B' ' 186' ' ' LEU . 12.6 mmm180 -61.36 -40.56 94.76 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.63 179.12 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -62.92 -42.58 99.85 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 120.37 -0.532 . . . . 0.0 109.969 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 192' ' ' LEU . . . . . . . . . . . . . 7.2 mt -67.91 -38.29 82.78 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.42 -179.542 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 95.9 35.28 5.64 Favored Glycine 0 CA--C 1.521 0.427 0 N-CA-C 111.23 -0.748 . . . . 0.0 111.23 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -98.4 -15.89 19.5 Favored 'General case' 0 CA--C 1.512 -0.511 0 O-C-N 122.916 -0.167 . . . . 0.0 111.079 179.558 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 26.5 m -136.4 158.44 37.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.11 -179.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 196' ' ' VAL . . . . . 0.44 ' CG1' ' N ' ' B' ' 197' ' ' GLY . 41.2 t -142.77 156.76 18.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.595 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 197' ' ' GLY . . . . . 0.44 ' N ' ' CG1' ' B' ' 196' ' ' VAL . . . -106.08 168.69 15.13 Favored Glycine 0 CA--C 1.523 0.572 0 N-CA-C 110.418 -1.073 . . . . 0.0 110.418 179.6 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 67.9 t0 . . . . . 0 C--N 1.328 -0.345 0 CA-C-O 120.769 0.319 . . . . 0.0 110.559 -179.654 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 21.4 t . . . . . 0 N--CA 1.466 0.364 0 N-CA-C 110.391 -0.226 . . . . 0.0 110.391 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 206' ' ' TYR . . . . . 0.404 ' CE1' ' CD2' ' B' ' 186' ' ' LEU . 45.0 m-85 -108.77 135.5 49.89 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.332 -179.668 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 83.5 p -151.56 172.06 16.62 Favored 'General case' 0 C--O 1.224 -0.289 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.429 -179.759 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . 55.3 mt -65.63 149.12 50.61 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.529 -179.764 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 11.7 t80 -52.44 -48.72 65.61 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.326 -179.631 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 42.5 p-10 -146.74 -178.94 6.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.77 0.319 . . . . 0.0 110.559 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 30.7 p -88.97 -17.04 30.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.374 -179.755 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 212' ' ' HIS . . . . . . . . . . . . . 46.3 m80 -45.12 -65.21 0.56 Allowed 'General case' 0 C--O 1.237 0.419 0 CA-C-O 121.045 0.45 . . . . 0.0 110.701 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 10.7 p -53.05 -35.64 23.05 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.178 -179.823 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 214' ' ' ALA . . . . . . . . . . . . . . . -62.09 -41.96 98.73 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.392 179.55 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -62.51 -45.12 94.43 Favored 'General case' 0 C--O 1.238 0.459 0 CA-C-N 116.172 -0.467 . . . . 0.0 109.894 -179.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 216' ' ' LEU . . . . . . . . . . . . . 18.4 tp -60.01 -42.38 94.16 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.06 -179.648 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 79.1 mt -63.72 -39.76 95.1 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.306 179.745 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 97.0 m-20 -59.66 -42.91 93.89 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.176 -179.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 219' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -67.16 -49.11 65.89 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.779 -0.368 . . . . 0.0 110.634 179.446 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -57.69 -44.99 86.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.285 -0.416 . . . . 0.0 109.924 179.689 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 4.8 mm -62.34 -43.98 98.7 Favored 'Isoleucine or valine' 0 C--O 1.237 0.442 0 CA-C-O 121.148 0.499 . . . . 0.0 110.612 -179.457 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -60.68 -42.22 96.66 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.937 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 223' ' ' HIS . . . . . . . . . . . . . 46.7 m170 -68.88 -36.3 77.91 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.113 179.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 43.0 t -58.73 -47.71 83.65 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.262 -179.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -74.9 -57.22 4.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.993 0.425 . . . . 0.0 110.586 179.236 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 59.2 m170 . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.125 -179.809 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 95.0 m-20 . . . . . 0 C--O 1.239 0.55 0 CA-C-O 121.258 0.552 . . . . 0.0 110.802 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 37.7 t -57.55 -42.75 83.57 Favored 'General case' 0 C--O 1.239 0.547 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.124 -179.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 9.1 mm100 -66.49 -42.66 87.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.28 179.521 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -51.74 -48.11 63.77 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 -179.209 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.34 -53.98 49.69 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 120.387 -0.525 . . . . 0.0 110.308 179.07 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -52.6 -48.24 66.41 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.03 179.803 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 85.8 mm-40 -56.32 -50.03 72.61 Favored 'General case' 0 C--O 1.241 0.614 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.688 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 84.2 t -60.12 -37.66 73.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.813 179.686 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.86 -42.07 95.16 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.411 178.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 67.1 m -56.9 -49.69 74.8 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.935 0.398 . . . . 0.0 110.99 -178.693 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.4 t -65.65 -48.68 71.32 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.725 179.832 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 69.1 mt -62.01 -26.06 68.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.946 179.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.667 ' NE2' ' NE2' ' B' ' 147' ' ' GLN . 29.6 tp60 -72.88 -60.12 2.38 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.352 179.224 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -55.64 -53.97 49.9 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.714 -179.189 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.511 ' O ' ' O ' ' A' ' 31' ' ' ALA . 7.3 mp -46.56 -35.45 5.83 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.397 -179.192 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.516 ' C ' ' HG1' ' A' ' 32' ' ' THR . . . -57.47 -132.69 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.45 0 O-C-N 123.52 0.512 . . . . 0.0 110.022 179.468 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.516 ' HG1' ' C ' ' A' ' 31' ' ' ALA . 0.8 OUTLIER 54.43 113.04 0.01 OUTLIER Pre-proline 0 CA--C 1.542 0.661 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.39 179.495 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -50.45 -57.58 2.2 Favored 'Trans proline' 0 N--CA 1.495 1.609 0 C-N-CA 122.283 1.989 . . . . 0.0 113.282 -179.541 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.503 ' HG ' ' N ' ' A' ' 35' ' ' ARG . 80.5 p -52.8 -46.09 67.52 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.22 -178.175 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.503 ' N ' ' HG ' ' A' ' 34' ' ' SER . 10.7 mpt_? -61.97 -42.67 99.4 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.637 -179.61 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.424 ' O ' ' OG1' ' A' ' 40' ' ' THR . 5.1 mt -61.37 -51.92 66.8 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 120.35 -0.54 . . . . 0.0 110.841 -179.159 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 11.2 tpt -53.83 -49.35 68.59 Favored 'General case' 0 C--O 1.24 0.574 0 C-N-CA 120.279 -0.568 . . . . 0.0 110.224 -179.62 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.431 HG23 HD12 ' A' ' 38' ' ' ILE . 96.7 mt -62.88 -45.58 98.5 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 CA-C-O 121.568 0.699 . . . . 0.0 110.405 -179.596 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 53.5 mt -62.21 -38.12 87.94 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.721 179.504 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.424 ' OG1' ' O ' ' A' ' 36' ' ' LEU . 18.0 m -59.41 -41.8 90.3 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.996 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.538 ' HG2' ' N ' ' A' ' 42' ' ' LEU . 0.0 OUTLIER -57.99 -43.82 86.8 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.282 -0.567 . . . . 0.0 110.269 179.839 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.538 ' N ' ' HG2' ' A' ' 41' ' ' GLN . 15.0 mt -64.19 -38.17 90.1 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.323 -179.411 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 73.6 ttp85 -51.0 -39.22 55.18 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.477 -179.402 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 51.4 t-20 -56.25 -39.55 72.77 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.411 -179.313 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 153.06 175.02 24.05 Favored Glycine 0 CA--C 1.524 0.595 0 N-CA-C 111.016 -0.834 . . . . 0.0 111.016 179.73 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -70.25 142.04 44.76 Favored 'Trans proline' 0 C--N 1.308 -1.6 0 C-N-CA 122.694 2.263 . . . . 0.0 111.764 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -162.81 160.62 19.44 Favored Pre-proline 0 C--N 1.326 -0.441 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.684 -179.838 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -63.26 142.01 84.47 Favored 'Trans proline' 0 N--CA 1.495 1.565 0 C-N-CA 122.519 2.146 . . . . 0.0 112.341 179.086 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 46.6 t -62.28 -43.16 97.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.423 179.457 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 89.6 m -55.86 -69.28 0.15 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.825 -179.317 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 63.1 t0 -52.23 -40.67 61.93 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.226 0.536 . . . . 0.0 109.719 -179.33 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.473 ' C ' ' CD1' ' A' ' 52' ' ' LEU . 2.9 tm? -59.02 -48.22 82.38 Favored 'General case' 0 C--N 1.316 -0.875 0 C-N-CA 119.732 -0.787 . . . . 0.0 110.336 -179.451 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.578 ' O ' ' N ' ' A' ' 58' ' ' MET . . . -56.34 -39.23 72.49 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.358 0.599 . . . . 0.0 110.315 -179.333 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -65.04 -28.8 69.73 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.592 179.476 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -63.28 -43.42 97.98 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.923 179.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 8.5 tt -164.14 -36.06 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.921 -179.556 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -54.74 -71.47 0.71 Allowed Glycine 0 CA--C 1.522 0.515 0 N-CA-C 111.205 -0.758 . . . . 0.0 111.205 -178.197 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.578 ' N ' ' O ' ' A' ' 53' ' ' ALA . 0.1 OUTLIER 64.64 27.21 13.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.678 0.275 . . . . 0.0 110.345 179.749 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -153.76 59.07 0.74 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.908 0.385 . . . . 0.0 110.034 -179.323 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 11.0 mt-30 -44.3 -26.05 0.29 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.525 -179.629 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 49.5 m -70.39 -46.12 64.65 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.896 179.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.76 -32.25 73.85 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.327 179.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 57.7 t -70.38 -50.63 44.64 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.273 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.689 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 11.2 t -58.08 -43.27 86.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.341 -179.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -62.12 -50.87 70.18 Favored 'General case' 0 C--O 1.239 0.501 0 CA-C-O 121.048 0.451 . . . . 0.0 110.79 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 86.6 mt-30 -63.36 -35.42 80.34 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.312 179.72 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 6.7 tp -62.99 -44.67 95.41 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.301 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -61.77 -40.7 96.11 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.796 0.331 . . . . 0.0 110.293 179.878 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 89.3 t -65.73 -54.28 29.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 C-N-CA 120.159 -0.616 . . . . 0.0 110.594 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 91.1 mt -60.9 -39.21 88.44 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.879 0.371 . . . . 0.0 110.059 -179.591 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 77.3 ttt-85 -59.63 -40.91 89.17 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.399 179.744 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 13.4 m120 -56.89 -47.53 80.27 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.338 -179.253 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.482 ' CD2' ' N ' ' A' ' 73' ' ' LEU . 4.0 mm? -65.89 -41.28 91.74 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.685 179.321 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 110.19 33.54 2.53 Favored Glycine 0 CA--C 1.526 0.749 0 N-CA-C 110.978 -0.849 . . . . 0.0 110.978 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.49 ' CD2' ' N ' ' A' ' 75' ' ' LEU . 3.8 mm? -91.2 -18.37 24.54 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.781 0.324 . . . . 0.0 110.601 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 31.6 m -136.38 160.13 38.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.159 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 46.5 t -134.54 142.07 41.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.421 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -115.57 140.7 16.42 Favored Glycine 0 CA--C 1.525 0.66 0 N-CA-C 110.496 -1.042 . . . . 0.0 110.496 179.299 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 . . . . . 0 N--CA 1.466 0.335 0 CA-C-O 120.837 0.351 . . . . 0.0 110.385 -179.915 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 54.5 t . . . . . 0 N--CA 1.464 0.231 0 N-CA-C 110.222 -0.288 . . . . 0.0 110.222 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 65.4 m-85 -110.72 133.22 53.53 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.325 179.787 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.625 ' HG ' ' H ' ' A' ' 89' ' ' LEU . 26.0 t -151.14 172.13 16.27 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.143 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.625 ' H ' ' HG ' ' A' ' 88' ' ' SER . 60.3 mt -69.61 147.67 50.38 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.629 -179.728 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 6.9 t80 -54.54 -47.66 72.91 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.36 -179.668 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 45.6 t0 -147.03 165.29 30.34 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.869 0.366 . . . . 0.0 110.601 -179.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 80.8 p -75.1 -22.32 58.33 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.578 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 25.6 m170 -40.22 -66.13 0.34 Allowed 'General case' 0 C--O 1.236 0.368 0 CA-C-O 121.101 0.477 . . . . 0.0 110.637 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 22.7 m -50.48 -35.35 12.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.101 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.55 -41.06 96.56 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.542 179.607 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 96.5 mm-40 -61.27 -45.79 93.05 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.925 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 15.2 tp -60.09 -43.53 95.45 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.302 -0.559 . . . . 0.0 110.102 -179.632 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 52.3 tp -64.21 -38.06 89.7 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.077 -179.77 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.9 m-20 -60.99 -43.5 98.74 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.233 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -67.02 -43.83 81.81 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.352 179.334 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.07 -44.04 91.81 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.183 -0.462 . . . . 0.0 109.78 179.216 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 4.8 mm -63.85 -43.71 97.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 121.213 0.53 . . . . 0.0 110.588 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -60.73 -44.4 96.71 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.082 -179.886 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' HIS . . . . . 0.623 ' ND1' ' N ' ' A' ' 105' ' ' SER . 0.0 OUTLIER -67.72 -34.65 77.28 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.103 179.523 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.623 ' N ' ' ND1' ' A' ' 104' ' ' HIS . 5.6 t -59.15 -50.59 73.46 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.383 -178.141 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 13.2 tm-20 -75.35 -52.89 9.72 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.93 179.265 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 4.2 m-70 . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.123 -178.733 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 91.0 m-20 . . . . . 0 C--O 1.237 0.441 0 CA-C-O 121.281 0.563 . . . . 0.0 110.979 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 5.6 t -57.67 -44.65 85.9 Favored 'General case' 0 C--O 1.24 0.555 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.444 -179.326 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 9.5 mm100 -66.44 -42.17 88.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.35 179.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 138' ' ' ALA . . . . . . . . . . . . . . . -51.7 -47.51 63.9 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.457 -0.572 . . . . 0.0 109.457 -179.049 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -61.53 -53.45 56.17 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 120.329 -0.548 . . . . 0.0 110.196 178.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -52.66 -47.36 67.16 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 120.74 -0.384 . . . . 0.0 111.088 179.767 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 88.6 mm-40 -56.61 -49.46 74.89 Favored 'General case' 0 C--O 1.241 0.608 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.647 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 142' ' ' VAL . . . . . . . . . . . . . 80.3 t -60.94 -38.31 79.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.891 179.617 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -64.36 -42.02 96.43 Favored 'General case' 0 C--O 1.22 -0.481 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.485 178.819 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 75.3 m -56.3 -50.05 72.54 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.914 0.388 . . . . 0.0 110.956 -178.736 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 1.4 t -65.81 -48.96 69.94 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.925 179.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 68.9 mt -61.44 -26.4 67.85 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.858 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 147' ' ' GLN . . . . . 0.667 ' NE2' ' NE2' ' A' ' 28' ' ' GLN . 31.0 tp60 -73.25 -59.08 2.87 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.341 179.178 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -56.24 -54.0 50.47 Favored 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 120.761 -0.375 . . . . 0.0 110.728 -179.319 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.512 ' O ' ' O ' ' B' ' 150' ' ' ALA . 7.4 mp -46.47 -34.75 5.01 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.266 -179.105 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 150' ' ' ALA . . . . . 0.512 ' O ' ' O ' ' B' ' 149' ' ' LEU . . . -57.6 -130.81 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.548 0 O-C-N 123.641 0.588 . . . . 0.0 109.955 179.381 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 151' ' ' THR . . . . . 0.49 ' O ' ' O ' ' B' ' 150' ' ' ALA . 0.7 OUTLIER 52.85 111.81 0.01 OUTLIER Pre-proline 0 CA--C 1.542 0.66 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.393 179.72 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -49.69 -57.02 2.58 Favored 'Trans proline' 0 N--CA 1.496 1.624 0 C-N-CA 122.149 1.899 . . . . 0.0 113.425 -179.381 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 153' ' ' SER . . . . . 0.502 ' HG ' ' N ' ' B' ' 154' ' ' ARG . 61.1 p -53.36 -46.34 69.54 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.165 -178.135 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 154' ' ' ARG . . . . . 0.502 ' N ' ' HG ' ' B' ' 153' ' ' SER . 10.6 mpt_? -61.28 -42.41 98.6 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.51 -179.623 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 155' ' ' LEU . . . . . 0.434 ' O ' ' OG1' ' B' ' 159' ' ' THR . 4.9 mt -61.58 -51.8 67.05 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 120.375 -0.53 . . . . 0.0 110.749 -179.178 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 11.4 tpt -53.91 -48.83 69.76 Favored 'General case' 0 C--O 1.24 0.6 0 C-N-CA 120.263 -0.575 . . . . 0.0 110.351 -179.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 157' ' ' ILE . . . . . 0.431 ' O ' ' HG2' ' B' ' 160' ' ' GLN . 96.6 mt -63.38 -45.41 98.15 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 CA-C-O 121.67 0.748 . . . . 0.0 110.395 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 52.4 mt -62.33 -38.29 88.9 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.574 179.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 159' ' ' THR . . . . . 0.434 ' OG1' ' O ' ' B' ' 155' ' ' LEU . 11.7 m -59.42 -42.7 92.44 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.977 -179.972 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 160' ' ' GLN . . . . . 0.545 ' HG2' ' N ' ' B' ' 161' ' ' LEU . 0.0 OUTLIER -57.14 -44.33 83.29 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 120.384 -0.526 . . . . 0.0 110.316 179.875 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 161' ' ' LEU . . . . . 0.545 ' N ' ' HG2' ' B' ' 160' ' ' GLN . 13.9 mt -64.55 -37.25 86.89 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.254 -179.335 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 162' ' ' ARG . . . . . . . . . . . . . 73.5 ttp85 -52.19 -38.2 57.11 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.323 -179.363 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 49.8 t-20 -56.32 -40.76 74.9 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.86 0.362 . . . . 0.0 110.212 -179.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . 153.18 178.07 27.37 Favored Glycine 0 CA--C 1.524 0.612 0 N-CA-C 111.17 -0.772 . . . . 0.0 111.17 179.09 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_exo -69.08 143.83 55.52 Favored 'Trans proline' 0 C--N 1.312 -1.382 0 C-N-CA 122.764 2.309 . . . . 0.0 112.103 -179.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -165.69 159.48 13.42 Favored Pre-proline 0 C--N 1.326 -0.427 0 C-N-CA 120.336 -0.546 . . . . 0.0 110.714 179.682 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -63.81 142.53 83.04 Favored 'Trans proline' 0 N--CA 1.495 1.598 0 C-N-CA 122.413 2.075 . . . . 0.0 112.367 178.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . 48.0 t -62.69 -42.85 97.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.398 179.437 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 169' ' ' THR . . . . . . . . . . . . . 17.0 m -55.83 -69.18 0.15 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.817 -179.608 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 47.6 t0 -52.39 -40.42 62.05 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-O 121.362 0.601 . . . . 0.0 109.818 -179.18 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 171' ' ' LEU . . . . . 0.483 ' C ' ' CD1' ' B' ' 171' ' ' LEU . 2.9 tm? -59.59 -47.95 83.55 Favored 'General case' 0 N--CA 1.439 -0.975 0 C-N-CA 119.707 -0.797 . . . . 0.0 110.413 -179.589 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 172' ' ' ALA . . . . . 0.553 ' O ' ' N ' ' B' ' 177' ' ' MET . . . -56.36 -39.69 73.31 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.345 0.593 . . . . 0.0 110.252 -179.444 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -64.3 -28.45 69.72 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.575 179.312 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -63.64 -41.0 98.28 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.093 -179.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 6.0 tt -168.72 -33.5 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.895 -179.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . -54.78 -63.87 4.85 Favored Glycine 0 CA--C 1.523 0.552 0 C-N-CA 120.812 -0.709 . . . . 0.0 111.472 -178.156 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 177' ' ' MET . . . . . 0.553 ' N ' ' O ' ' B' ' 172' ' ' ALA . 3.4 mmt 56.07 29.22 14.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.716 0.293 . . . . 0.0 110.269 -179.917 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 86.4 mt-10 -155.35 60.87 0.63 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.36 -179.575 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 -47.1 -28.19 1.66 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.504 -179.583 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 48.0 m -69.92 -45.4 67.62 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.769 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -65.02 -32.21 73.83 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.437 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 63.5 t -70.22 -50.5 46.44 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.266 0 C-N-CA 120.873 -0.331 . . . . 0.0 110.755 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 13.5 t -58.7 -41.81 87.13 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.217 -179.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -62.6 -50.97 69.16 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-O 121.089 0.471 . . . . 0.0 110.779 -179.963 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -64.12 -34.12 77.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.145 179.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 7.2 tp -63.47 -45.15 92.12 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.172 179.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -61.81 -41.74 98.14 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.752 0.31 . . . . 0.0 110.262 -179.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 83.9 t -64.07 -54.67 28.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 C-N-CA 120.107 -0.637 . . . . 0.0 110.474 -179.834 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 93.0 mt -61.07 -39.07 88.5 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 -179.445 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 73.0 ttt-85 -58.72 -40.43 83.73 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.482 179.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 17.6 m120 -58.17 -46.43 85.74 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.674 -0.41 . . . . 0.0 110.442 -179.468 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 192' ' ' LEU . . . . . 0.489 ' CD2' ' N ' ' B' ' 192' ' ' LEU . 3.9 mm? -66.49 -41.01 89.59 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.631 179.4 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 108.74 34.57 2.59 Favored Glycine 0 CA--C 1.524 0.608 0 N-CA-C 111.015 -0.834 . . . . 0.0 111.015 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 194' ' ' LEU . . . . . 0.49 ' CD2' ' N ' ' B' ' 194' ' ' LEU . 3.9 mm? -92.31 -17.6 24.5 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.82 0.343 . . . . 0.0 110.519 179.942 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 27.5 m -137.29 160.49 35.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.232 179.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 196' ' ' VAL . . . . . . . . . . . . . 50.4 t -135.49 143.59 36.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.284 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 197' ' ' GLY . . . . . . . . . . . . . . . -117.09 141.15 16.45 Favored Glycine 0 CA--C 1.523 0.575 0 N-CA-C 110.643 -0.983 . . . . 0.0 110.643 179.605 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 . . . . . 0 N--CA 1.467 0.389 0 CA-C-O 120.864 0.364 . . . . 0.0 110.466 179.943 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 58.5 t . . . . . 0 N--CA 1.464 0.25 0 N-CA-C 110.189 -0.3 . . . . 0.0 110.189 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 -111.85 133.84 53.8 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.429 179.691 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 207' ' ' SER . . . . . 0.586 ' HG ' ' N ' ' B' ' 208' ' ' LEU . 45.5 t -151.78 172.33 16.31 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.211 179.902 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 208' ' ' LEU . . . . . 0.586 ' N ' ' HG ' ' B' ' 207' ' ' SER . 56.8 mt -69.11 147.72 51.02 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.56 -179.729 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 7.2 t80 -54.56 -46.29 73.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.257 -179.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 210' ' ' ASP . . . . . 0.509 ' OD2' ' CD2' ' B' ' 212' ' ' HIS . 45.2 t0 -147.91 170.58 17.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.557 -179.665 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 81.6 p -80.14 -19.36 47.41 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.63 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 212' ' ' HIS . . . . . 0.509 ' CD2' ' OD2' ' B' ' 210' ' ' ASP . 22.3 m170 -43.38 -65.84 0.45 Allowed 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.159 0.504 . . . . 0.0 110.738 -179.851 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 29.4 m -50.41 -36.8 13.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.214 -179.667 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 214' ' ' ALA . . . . . . . . . . . . . . . -63.16 -40.28 97.1 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.501 179.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 97.4 mm-40 -62.36 -45.89 91.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.987 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 216' ' ' LEU . . . . . . . . . . . . . 15.3 tp -59.62 -43.55 93.76 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.227 -0.589 . . . . 0.0 110.02 -179.551 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 56.1 tp -63.89 -39.58 94.5 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.046 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 99.9 m-20 -59.41 -44.04 92.9 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.352 -179.599 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 219' ' ' GLU . . . . . . . . . . . . . 67.7 mm-40 -66.26 -44.02 84.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.457 179.105 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -59.32 -44.17 92.61 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 179.284 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 4.7 mm -63.36 -44.01 98.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 121.158 0.504 . . . . 0.0 110.457 -179.886 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 222' ' ' TYR . . . . . 0.441 ' O ' ' CG ' ' B' ' 226' ' ' HIS . 3.8 m-85 -61.2 -42.83 99.29 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.111 -179.801 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 223' ' ' HIS . . . . . 0.629 ' ND1' ' N ' ' B' ' 224' ' ' SER . 0.0 OUTLIER -68.76 -36.37 78.25 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.061 0.458 . . . . 0.0 110.228 179.431 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 224' ' ' SER . . . . . 0.629 ' N ' ' ND1' ' B' ' 223' ' ' HIS . 41.6 t -58.84 -49.09 79.04 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.122 -178.097 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 9.6 tm-20 -75.58 -54.42 7.02 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.955 179.135 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 226' ' ' HIS . . . . . 0.441 ' CG ' ' O ' ' B' ' 222' ' ' TYR . 4.7 m-70 . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.21 -178.695 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . 0.506 ' O ' ' N ' ' A' ' 19' ' ' ALA . 19.1 t70 . . . . . 0 N--CA 1.462 0.148 0 CA-C-O 120.593 0.235 . . . . 0.0 110.82 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 42.2 t -38.72 -42.33 0.79 Allowed 'General case' 0 C--O 1.241 0.657 0 CA-C-O 121.375 0.607 . . . . 0.0 110.381 -179.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 54.6 mt-30 -65.32 -43.3 91.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.164 179.022 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.506 ' N ' ' O ' ' A' ' 16' ' ' ASP . . . -62.61 -31.44 72.28 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.108 179.639 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.88 -53.27 53.21 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 179.683 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.37 -46.14 83.69 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.489 -0.484 . . . . 0.0 110.81 179.365 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 59.3 tt0 -56.1 -51.11 69.07 Favored 'General case' 0 C--O 1.242 0.668 0 CA-C-O 121.544 0.687 . . . . 0.0 110.38 -179.778 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 75.2 t -62.41 -43.31 98.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.753 179.558 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -49.39 -50.22 41.22 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.299 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 58.1 m -59.18 -42.34 90.59 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 91.2 m -63.31 -50.92 68.13 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 120.363 -0.535 . . . . 0.0 111.105 179.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 96.0 mt -68.35 -22.16 64.69 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.56 -179.739 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 49.5 tt0 -74.69 -58.0 3.57 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.281 179.559 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.6 -54.14 50.38 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.722 -0.391 . . . . 0.0 110.283 -179.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.496 ' O ' ' O ' ' A' ' 31' ' ' ALA . 77.1 mt -44.91 -33.14 1.86 Allowed 'General case' 0 CA--C 1.513 -0.481 0 C-N-CA 121.024 -0.27 . . . . 0.0 110.458 -179.198 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.496 ' O ' ' O ' ' A' ' 30' ' ' LEU . . . -57.61 -128.27 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.12 179.233 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.421 ' O ' ' O ' ' A' ' 31' ' ' ALA . 0.6 OUTLIER 54.26 107.18 0.03 OUTLIER Pre-proline 0 CA--C 1.54 0.579 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.571 -179.959 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -49.27 -58.68 1.6 Allowed 'Trans proline' 0 N--CA 1.496 1.663 0 C-N-CA 122.165 1.91 . . . . 0.0 113.429 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 78.4 p -55.54 -43.33 75.69 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.802 -179.149 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 44.4 ttm180 -61.06 -44.29 97.61 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 120.817 -0.353 . . . . 0.0 110.663 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 7.1 mt -61.03 -45.74 93.57 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.467 -0.493 . . . . 0.0 110.908 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.464 ' C ' ' SD ' ' A' ' 37' ' ' MET . 0.0 OUTLIER -55.21 -46.79 75.91 Favored 'General case' 0 C--N 1.319 -0.741 0 C-N-CA 120.15 -0.62 . . . . 0.0 110.163 -179.886 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.484 ' CD1' ' OE1' ' A' ' 66' ' ' GLN . 65.0 mt -63.72 -45.34 97.59 Favored 'Isoleucine or valine' 0 C--O 1.239 0.532 0 CA-C-O 121.601 0.715 . . . . 0.0 110.734 -179.824 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -63.28 -40.95 98.83 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.765 179.827 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.454 ' OG1' ' O ' ' A' ' 37' ' ' MET . 15.3 p -61.42 -37.34 83.15 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.944 179.974 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -62.1 -47.46 84.53 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.516 -0.474 . . . . 0.0 109.855 179.335 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 29.3 mt -64.54 -35.39 80.8 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.762 179.525 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 62.5 ttp180 -55.15 -31.94 61.73 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.57 -179.521 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 98.4 m-20 -61.15 -41.03 96.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.507 -179.647 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.42 ' O ' ' CD2' ' A' ' 47' ' ' LEU . . . 155.83 -160.38 29.96 Favored Glycine 0 CA--C 1.528 0.847 0 N-CA-C 110.951 -0.86 . . . . 0.0 110.951 180.0 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_exo -61.67 144.08 97.07 Favored 'Trans proline' 0 C--N 1.309 -1.528 0 C-N-CA 122.96 2.44 . . . . 0.0 111.976 179.499 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.42 ' CD2' ' O ' ' A' ' 45' ' ' GLY . 0.3 OUTLIER 176.95 94.21 0.12 Allowed Pre-proline 0 CA--C 1.538 0.507 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.353 179.706 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo -48.32 177.88 0.01 OUTLIER 'Trans proline' 0 C--N 1.297 -2.155 0 C-N-CA 122.282 1.988 . . . . 0.0 112.485 -179.737 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.48 ' CG2' ' N ' ' A' ' 50' ' ' THR . 4.7 m -59.97 -42.39 89.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 121.51 0.671 . . . . 0.0 110.367 -179.759 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.48 ' N ' ' CG2' ' A' ' 49' ' ' VAL . 11.1 m -59.87 -41.4 91.43 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.007 -0.997 . . . . 0.0 110.537 179.641 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -73.95 -46.58 43.21 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.702 179.57 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.2 tt -61.42 -45.52 93.97 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.586 -179.281 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.86 -46.33 78.85 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.666 -0.414 . . . . 0.0 111.281 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -55.61 -35.81 66.27 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.138 -179.429 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -50.96 -59.59 3.98 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.516 -0.473 . . . . 0.0 110.708 -179.291 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 2.2 pp -158.84 -18.17 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.605 -179.704 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -58.84 -64.78 3.98 Favored Glycine 0 CA--C 1.523 0.552 0 N-CA-C 111.209 -0.756 . . . . 0.0 111.209 -179.171 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.488 ' O ' ' SD ' ' A' ' 58' ' ' MET . 0.0 OUTLIER 67.73 40.45 2.45 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.713 0.292 . . . . 0.0 110.328 179.996 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.477 ' O ' ' N ' ' A' ' 61' ' ' SER . 72.1 tt0 -169.01 60.86 0.05 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 13.1 mt-30 -41.45 -23.12 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.766 -179.434 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.477 ' N ' ' O ' ' A' ' 59' ' ' GLU . 69.3 m -68.7 -43.34 76.24 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.917 179.923 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.418 ' H ' ' HG2' ' A' ' 59' ' ' GLU . . . -68.12 -30.5 69.66 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.628 -179.888 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 59.4 t -72.18 -51.59 29.27 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.294 0 C-N-CA 120.882 -0.327 . . . . 0.0 110.845 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 40.8 t -59.8 -42.28 93.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.33 -179.738 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -62.82 -51.21 67.92 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-O 120.986 0.422 . . . . 0.0 110.995 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . 0.484 ' OE1' ' CD1' ' A' ' 38' ' ' ILE . 73.5 mt-30 -63.66 -36.87 85.27 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.055 0.455 . . . . 0.0 110.471 179.968 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 5.9 tt -62.1 -43.75 98.15 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.479 -179.76 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -62.97 -41.79 99.64 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.862 0.363 . . . . 0.0 110.434 179.459 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 75.5 t -61.52 -54.18 38.42 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.206 0 C-N-CA 119.88 -0.728 . . . . 0.0 110.134 -179.726 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 94.9 mt -62.31 -37.31 85.09 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.175 0.512 . . . . 0.0 109.851 -179.561 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 7.4 tmm_? -57.34 -38.82 74.71 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.454 -179.842 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 99.0 m-20 -62.07 -41.09 97.81 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.421 -179.823 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 7.2 mt -66.02 -39.11 89.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.242 -179.488 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 102.79 31.72 5.03 Favored Glycine 0 CA--C 1.525 0.678 0 N-CA-C 111.011 -0.836 . . . . 0.0 111.011 -179.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 83.9 mt -95.04 -15.7 23.26 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 120.751 0.31 . . . . 0.0 110.701 179.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 33.4 m -136.88 160.7 36.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.088 179.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 40.3 t -137.71 150.42 25.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.345 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -124.74 145.89 15.94 Favored Glycine 0 CA--C 1.52 0.397 0 N-CA-C 110.237 -1.145 . . . . 0.0 110.237 179.437 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 . . . . . 0 C--O 1.236 0.363 0 CA-C-O 120.827 0.346 . . . . 0.0 110.469 -179.996 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 78.8 t . . . . . 0 C--O 1.231 0.124 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 -104.86 129.94 53.09 Favored 'General case' 0 CA--C 1.52 -0.181 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 50.7 m -149.24 171.38 16.58 Favored 'General case' 0 N--CA 1.462 0.151 0 N-CA-C 110.049 -0.352 . . . . 0.0 110.049 -179.685 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 17.7 mt -67.98 148.96 50.33 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.428 -179.304 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -52.01 -44.92 64.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.2 -179.582 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.532 ' OD2' ' CD2' ' A' ' 93' ' ' HIS . 13.2 t70 -147.44 -177.55 5.76 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.327 -179.97 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' THR . . . . . 0.489 ' H ' ' CG ' ' A' ' 91' ' ' ASP . 6.6 p -90.86 -13.46 33.65 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.576 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . 0.532 ' CD2' ' OD2' ' A' ' 91' ' ' ASP . 91.2 m-70 -48.74 -65.08 0.63 Allowed 'General case' 0 C--O 1.235 0.323 0 CA-C-O 120.809 0.337 . . . . 0.0 110.712 179.879 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 27.2 m -50.74 -38.79 17.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.062 -179.684 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.66 -41.07 97.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.338 179.778 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 64.6 tp60 -61.92 -45.72 92.46 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.866 -179.615 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 13.0 tp -59.4 -42.32 91.47 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.584 -0.446 . . . . 0.0 110.133 -179.257 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 92.7 mt -63.33 -40.23 96.73 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.149 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . 0.435 ' OD1' ' CE1' ' A' ' 103' ' ' TYR . 65.7 t0 -60.22 -42.58 95.49 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.201 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -67.09 -50.22 62.33 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.491 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -56.19 -43.28 78.3 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 179.621 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 4.6 mm -62.48 -43.69 98.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 C-N-CA 120.384 -0.526 . . . . 0.0 110.439 -179.735 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' TYR . . . . . 0.435 ' CE1' ' OD1' ' A' ' 99' ' ' ASP . 3.3 m-85 -58.87 -41.31 86.77 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.868 -179.942 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 68.7 t60 -65.8 -38.78 89.89 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.619 179.501 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 43.2 t -58.96 -46.32 88.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.24 -179.638 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -75.01 -58.05 3.52 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.008 0.432 . . . . 0.0 110.954 179.228 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 84.7 t60 . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 115.725 -0.671 . . . . 0.0 109.735 -179.341 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 135' ' ' ASP . . . . . 0.498 ' O ' ' N ' ' B' ' 138' ' ' ALA . 20.3 t70 . . . . . 0 N--CA 1.46 0.07 0 CA-C-O 120.698 0.285 . . . . 0.0 110.758 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 25.8 t -38.47 -42.05 0.71 Allowed 'General case' 0 C--O 1.242 0.659 0 CA-C-O 121.218 0.533 . . . . 0.0 110.484 -179.722 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 74.9 mt-30 -65.45 -43.59 89.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.041 179.146 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 138' ' ' ALA . . . . . 0.498 ' N ' ' O ' ' B' ' 135' ' ' ASP . . . -62.97 -31.34 72.43 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.211 179.729 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -64.12 -53.11 54.75 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 120.957 0.408 . . . . 0.0 109.901 179.677 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -57.63 -46.78 83.7 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.737 179.424 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -55.9 -50.02 71.83 Favored 'General case' 0 C--O 1.242 0.67 0 CA-C-O 121.563 0.697 . . . . 0.0 110.171 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 142' ' ' VAL . . . . . . . . . . . . . 77.7 t -62.61 -43.56 98.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.688 179.611 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -49.63 -49.27 47.73 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.418 179.888 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 55.2 m -59.17 -43.0 92.12 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.33 -0.395 . . . . 0.0 109.977 179.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 89.0 m -63.27 -50.39 70.33 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 120.386 -0.526 . . . . 0.0 110.995 179.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 96.0 mt -68.82 -22.78 64.22 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.799 -179.785 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 147' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -74.62 -57.63 3.8 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.402 179.483 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -58.63 -54.13 50.52 Favored 'General case' 0 CA--C 1.519 -0.227 0 C-N-CA 120.57 -0.452 . . . . 0.0 110.388 -179.579 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.501 ' O ' ' O ' ' B' ' 150' ' ' ALA . 77.5 mt -45.26 -33.53 2.42 Favored 'General case' 0 CA--C 1.513 -0.465 0 C-N-CA 121.021 -0.272 . . . . 0.0 110.441 -178.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 150' ' ' ALA . . . . . 0.501 ' O ' ' O ' ' B' ' 149' ' ' LEU . . . -57.1 -128.35 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.238 0.542 . . . . 0.0 110.309 179.363 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 151' ' ' THR . . . . . 0.433 ' O ' ' O ' ' B' ' 150' ' ' ALA . 0.6 OUTLIER 54.3 108.61 0.02 OUTLIER Pre-proline 0 CA--C 1.541 0.623 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.558 -179.722 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -49.73 -59.18 1.32 Allowed 'Trans proline' 0 N--CA 1.494 1.555 0 C-N-CA 122.197 1.931 . . . . 0.0 113.317 179.73 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 84.3 p -54.92 -43.96 73.78 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.812 -179.101 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 44.2 ttm180 -60.79 -44.43 96.84 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.574 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 155' ' ' LEU . . . . . . . . . . . . . 7.2 mt -60.92 -46.16 91.78 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.365 -0.534 . . . . 0.0 110.694 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 156' ' ' MET . . . . . 0.477 ' C ' ' SD ' ' B' ' 156' ' ' MET . 0.0 OUTLIER -54.58 -47.22 73.56 Favored 'General case' 0 C--N 1.318 -0.764 0 C-N-CA 120.116 -0.634 . . . . 0.0 110.131 -179.91 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 157' ' ' ILE . . . . . 0.452 ' CD1' ' OE1' ' B' ' 185' ' ' GLN . 67.4 mt -63.61 -45.78 96.64 Favored 'Isoleucine or valine' 0 C--O 1.239 0.544 0 CA-C-O 121.483 0.658 . . . . 0.0 110.808 -179.757 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -63.01 -40.45 97.81 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.866 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 159' ' ' THR . . . . . 0.477 ' OG1' ' O ' ' B' ' 156' ' ' MET . 18.1 p -61.22 -38.17 85.66 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 116.088 -0.505 . . . . 0.0 109.938 -180.0 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 14.4 mm100 -61.52 -47.29 86.27 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.549 -0.46 . . . . 0.0 109.923 179.395 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 161' ' ' LEU . . . . . . . . . . . . . 29.4 mt -64.71 -34.79 79.15 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.837 179.622 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 162' ' ' ARG . . . . . . . . . . . . . 62.6 ttp180 -56.3 -30.79 62.97 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.674 -179.46 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 98.1 m-20 -61.74 -41.1 97.21 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.462 -179.631 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 164' ' ' GLY . . . . . 0.427 ' O ' ' CD2' ' B' ' 166' ' ' LEU . . . 156.49 -160.44 30.22 Favored Glycine 0 CA--C 1.526 0.755 0 N-CA-C 110.887 -0.885 . . . . 0.0 110.887 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_exo -62.13 143.25 94.37 Favored 'Trans proline' 0 C--N 1.308 -1.556 0 C-N-CA 123.016 2.477 . . . . 0.0 112.024 179.434 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 166' ' ' LEU . . . . . 0.427 ' CD2' ' O ' ' B' ' 164' ' ' GLY . 0.3 OUTLIER 177.96 95.13 0.14 Allowed Pre-proline 0 CA--C 1.538 0.499 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.408 179.682 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_exo -48.51 177.94 0.02 OUTLIER 'Trans proline' 0 C--N 1.299 -2.075 0 C-N-CA 122.353 2.035 . . . . 0.0 112.377 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 168' ' ' VAL . . . . . 0.468 ' CG2' ' N ' ' B' ' 169' ' ' THR . 4.2 m -59.87 -42.36 88.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 121.589 0.709 . . . . 0.0 110.388 -179.728 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 169' ' ' THR . . . . . 0.468 ' N ' ' CG2' ' B' ' 168' ' ' VAL . 9.8 m -59.48 -40.84 88.29 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.454 179.902 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -74.11 -46.33 43.41 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.759 179.517 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 4.8 tt -61.64 -44.2 97.43 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.348 -178.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 172' ' ' ALA . . . . . . . . . . . . . . . -67.35 -46.94 71.91 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.131 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 82.3 tt0 -54.93 -36.38 65.2 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.219 -179.479 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -51.15 -59.6 4.01 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.463 -0.495 . . . . 0.0 110.821 -179.19 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 2.2 pp -159.08 -17.4 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.567 -179.493 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . -60.12 -64.17 4.4 Favored Glycine 0 CA--C 1.524 0.595 0 N-CA-C 111.112 -0.795 . . . . 0.0 111.112 -179.347 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 177' ' ' MET . . . . . 0.495 ' O ' ' SD ' ' B' ' 177' ' ' MET . 0.0 OUTLIER 66.71 40.78 3.16 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.707 0.289 . . . . 0.0 110.268 179.927 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 178' ' ' GLU . . . . . 0.49 ' O ' ' N ' ' B' ' 180' ' ' SER . 71.9 tt0 -168.33 60.41 0.06 Allowed 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 179.919 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 13.2 mt-30 -41.27 -22.82 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.766 -179.378 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 180' ' ' SER . . . . . 0.49 ' N ' ' O ' ' B' ' 178' ' ' GLU . 49.1 m -68.84 -43.85 74.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.99 179.831 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 181' ' ' ALA . . . . . 0.429 ' H ' ' HG2' ' B' ' 178' ' ' GLU . . . -68.02 -30.16 69.34 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.591 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 57.9 t -72.03 -51.66 29.49 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 C-N-CA 120.811 -0.356 . . . . 0.0 110.893 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 6.5 t -59.54 -42.61 92.73 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.255 -179.763 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -62.85 -50.69 69.95 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 120.931 0.396 . . . . 0.0 110.979 -179.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 185' ' ' GLN . . . . . 0.452 ' OE1' ' CD1' ' B' ' 157' ' ' ILE . 74.2 mt-30 -63.62 -36.72 84.75 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.533 179.915 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 5.8 tt -62.79 -44.07 97.14 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.662 -179.818 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -62.51 -41.78 99.06 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.413 179.607 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 76.8 t -61.66 -54.26 37.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 C-N-CA 119.881 -0.728 . . . . 0.0 110.174 -179.765 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 86.6 mt -62.26 -37.49 85.65 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.233 0.54 . . . . 0.0 109.954 -179.517 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 7.3 tmm_? -56.93 -40.07 75.67 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.454 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -61.33 -41.28 96.77 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.881 0.372 . . . . 0.0 110.325 -179.512 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 192' ' ' LEU . . . . . . . . . . . . . 7.3 mt -65.53 -38.89 90.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.398 -179.508 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 102.46 30.26 5.67 Favored Glycine 0 CA--C 1.524 0.633 0 N-CA-C 110.857 -0.897 . . . . 0.0 110.857 -179.844 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 94.6 mt -93.66 -16.37 24.37 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.85 0.357 . . . . 0.0 110.689 179.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 35.7 m -136.53 160.47 37.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.323 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 196' ' ' VAL . . . . . . . . . . . . . 42.8 t -138.42 152.38 25.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.159 179.783 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 197' ' ' GLY . . . . . . . . . . . . . . . -127.44 147.64 17.15 Favored Glycine 0 CA--C 1.523 0.565 0 N-CA-C 110.448 -1.061 . . . . 0.0 110.448 179.685 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 . . . . . 0 N--CA 1.466 0.333 0 CA-C-O 120.897 0.38 . . . . 0.0 110.524 179.937 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 70.8 t . . . . . 0 N--CA 1.461 0.103 0 N-CA-C 109.959 -0.385 . . . . 0.0 109.959 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 -104.71 129.45 52.91 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 45.3 m -148.82 171.01 16.96 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 110.019 -0.363 . . . . 0.0 110.019 -179.627 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . 18.6 mt -68.41 149.78 48.93 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.454 -179.356 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 9.2 t80 -52.25 -46.44 65.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.316 -179.457 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 210' ' ' ASP . . . . . 0.541 ' CG ' ' H ' ' B' ' 211' ' ' THR . 19.0 t70 -146.17 -178.71 6.28 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.791 0.329 . . . . 0.0 110.295 -179.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 211' ' ' THR . . . . . 0.541 ' H ' ' CG ' ' B' ' 210' ' ' ASP . 30.7 p -88.5 -16.47 32.6 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.535 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 212' ' ' HIS . . . . . 0.523 ' CD2' ' OD2' ' B' ' 210' ' ' ASP . 84.2 m-70 -46.47 -65.44 0.55 Allowed 'General case' 0 C--O 1.235 0.312 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.868 -179.834 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 20.3 m -50.38 -38.42 15.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 121.016 0.436 . . . . 0.0 110.139 -179.561 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 214' ' ' ALA . . . . . . . . . . . . . . . -62.21 -40.93 97.74 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.215 179.754 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 68.0 tp60 -62.19 -46.05 90.66 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.871 -179.541 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 216' ' ' LEU . . . . . . . . . . . . . 14.5 tp -59.0 -42.97 91.37 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.003 -179.138 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 88.5 mt -62.8 -40.59 97.83 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.206 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 67.1 t0 -59.37 -43.79 92.83 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.333 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 219' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -66.43 -49.8 65.54 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.438 -0.347 . . . . 0.0 110.547 179.541 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -56.3 -43.02 78.5 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.855 -0.424 . . . . 0.0 109.855 179.496 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 4.2 mm -62.68 -43.55 98.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 C-N-CA 120.39 -0.524 . . . . 0.0 110.463 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -59.09 -41.3 87.72 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.797 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 223' ' ' HIS . . . . . . . . . . . . . 58.8 t60 -65.84 -37.93 87.53 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.471 179.504 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 6.7 t -58.92 -46.99 86.62 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.389 -179.747 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -75.39 -56.69 4.46 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 121.005 0.431 . . . . 0.0 110.898 179.309 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 85.7 t60 . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.864 -179.441 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 . . . . . 0 C--O 1.235 0.332 0 CA-C-O 121.097 0.475 . . . . 0.0 110.555 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 98.5 p -58.25 -33.48 69.41 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.459 -179.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -67.19 -49.41 64.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.501 179.428 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -56.81 -36.79 70.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.165 -179.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.31 -53.31 37.96 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.407 179.565 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.06 -44.95 94.35 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.952 -179.716 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -58.9 -50.65 73.24 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.255 0.55 . . . . 0.0 110.339 -179.806 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 70.9 t -62.1 -44.4 98.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.94 179.562 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.27 -43.13 82.8 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.137 179.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 66.2 m -57.56 -43.51 84.56 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 179.793 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 21.4 m -64.22 -49.06 73.46 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.631 -0.428 . . . . 0.0 110.685 179.207 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 85.9 mt -63.42 -22.53 66.94 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.442 -179.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 57.6 tt0 -75.33 -57.98 3.56 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.654 179.42 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.21 -54.54 44.55 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.932 -179.391 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.549 ' O ' ' O ' ' A' ' 31' ' ' ALA . 3.9 mm? -48.74 -30.4 5.56 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 -178.962 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.549 ' O ' ' O ' ' A' ' 30' ' ' LEU . . . -56.54 -133.95 0.0 OUTLIER 'General case' 0 C--O 1.22 -0.498 0 C-N-CA 120.366 -0.534 . . . . 0.0 110.362 179.102 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.519 ' HG1' ' C ' ' A' ' 31' ' ' ALA . 17.7 p 53.85 114.76 0.01 OUTLIER Pre-proline 0 CA--C 1.543 0.679 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.867 -179.807 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_exo -48.76 -44.54 31.1 Favored 'Trans proline' 0 N--CA 1.498 1.754 0 C-N-CA 122.229 1.953 . . . . 0.0 113.026 -179.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 39.5 t -59.92 -45.46 92.49 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.959 -178.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 15.7 tpp180 -63.4 -36.47 83.82 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.388 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.451 ' CD2' ' O ' ' A' ' 30' ' ' LEU . 1.6 mm? -63.15 -54.38 38.66 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.414 -0.514 . . . . 0.0 110.763 -179.181 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.461 ' O ' ' OG1' ' A' ' 40' ' ' THR . 0.0 OUTLIER -57.18 -49.23 76.61 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.008 -0.677 . . . . 0.0 110.639 -179.396 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 36.6 mm -62.62 -42.75 97.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-O 121.193 0.521 . . . . 0.0 110.383 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 42.6 tp -62.38 -43.03 99.77 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.785 -179.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.461 ' OG1' ' O ' ' A' ' 37' ' ' MET . 19.7 p -60.71 -35.88 77.43 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.305 -0.407 . . . . 0.0 109.997 -179.446 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -63.46 -45.85 88.91 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.274 -0.571 . . . . 0.0 110.108 178.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 98.1 mt -64.94 -42.54 94.55 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.951 179.701 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.532 ' NH1' ' OD1' ' A' ' 99' ' ' ASP . 68.7 ttp85 -52.04 -17.76 1.16 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.428 -179.9 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -75.91 -76.91 0.14 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.908 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -174.45 -143.67 4.51 Favored Glycine 0 CA--C 1.532 1.131 0 C-N-CA 120.539 -0.839 . . . . 0.0 111.217 -179.509 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -50.16 133.08 34.99 Favored 'Trans proline' 0 N--CA 1.493 1.464 0 C-N-CA 122.328 2.019 . . . . 0.0 112.184 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -136.68 66.79 57.53 Favored Pre-proline 0 CA--C 1.536 0.43 0 CA-C-O 121.547 0.689 . . . . 0.0 111.207 -179.941 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -51.61 148.51 20.85 Favored 'Trans proline' 0 C--N 1.299 -2.028 0 C-N-CA 121.852 1.701 . . . . 0.0 111.343 178.185 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 44.4 t -53.32 -51.4 41.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 121.253 0.549 . . . . 0.0 110.574 -178.377 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 48.4 p -62.92 -38.53 91.33 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.529 179.336 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -63.71 -41.39 98.11 Favored 'General case' 0 CA--C 1.514 -0.404 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.933 179.287 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.467 ' C ' ' CD1' ' A' ' 52' ' ' LEU . 2.8 tm? -61.58 -47.69 84.33 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 119.675 -0.81 . . . . 0.0 110.11 -179.492 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.515 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -52.69 -47.23 67.38 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.006 179.632 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 45.1 tp10 -54.85 -48.09 73.33 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.516 -0.474 . . . . 0.0 110.35 179.751 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -57.31 -54.0 51.71 Favored 'General case' 0 C--O 1.232 0.138 0 C-N-CA 120.493 -0.483 . . . . 0.0 111.012 -179.589 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.401 HD13 HG22 ' A' ' 56' ' ' ILE . 96.6 mt -89.08 -75.02 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.241 179.71 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . 0.515 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 133.02 96.97 0.63 Allowed Glycine 0 CA--C 1.522 0.513 0 N-CA-C 111.391 -0.684 . . . . 0.0 111.391 179.858 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 78.3 mtm 58.32 77.58 0.29 Allowed 'General case' 0 C--O 1.232 0.155 0 C-N-CA 120.974 -0.29 . . . . 0.0 110.878 179.117 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -173.33 32.63 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.25 0.548 . . . . 0.0 110.083 179.733 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . 0.572 ' H ' ' CD ' ' A' ' 60' ' ' GLN . 0.0 OUTLIER -82.72 -25.06 33.27 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.612 -179.162 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.512 ' O ' ' ND1' ' A' ' 65' ' ' HIS . 73.1 m -65.82 -42.94 90.0 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.395 -179.917 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.56 -36.8 76.67 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.506 179.754 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 55.1 t -69.78 -52.24 33.39 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.3 0 C-N-CA 120.495 -0.482 . . . . 0.0 110.802 179.759 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 11.7 t -60.44 -44.58 95.67 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.234 -0.587 . . . . 0.0 110.51 179.691 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' HIS . . . . . 0.562 ' CG ' HH21 ' A' ' 68' ' ' ARG . 0.9 OUTLIER -57.03 -47.54 80.67 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.41 -179.844 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 81.6 mt-30 -59.51 -41.53 90.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.86 0.362 . . . . 0.0 110.836 179.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -61.31 -44.14 97.71 Favored 'General case' 0 CA--C 1.513 -0.457 0 C-N-CA 120.616 -0.434 . . . . 0.0 110.56 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.562 HH21 ' CG ' ' A' ' 65' ' ' HIS . 88.2 mtm180 -61.61 -40.82 96.2 Favored 'General case' 0 C--N 1.312 -1.035 0 C-N-CA 120.402 -0.519 . . . . 0.0 110.62 179.777 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 94.8 t -58.83 -52.31 61.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 -179.463 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 9.9 mp -67.06 -31.46 71.99 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.854 0.359 . . . . 0.0 110.282 179.042 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.657 HH12 ' N ' ' A' ' 78' ' ' GLY . 9.2 tpt180 -54.65 -43.83 72.69 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.881 -179.169 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -60.8 -43.59 97.96 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.329 -0.548 . . . . 0.0 110.38 179.87 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 10.0 mt -64.91 -38.92 92.59 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.024 0.44 . . . . 0.0 110.537 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 99.29 35.91 4.57 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 110.96 -0.856 . . . . 0.0 110.96 -179.722 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 85.0 mt -99.29 -19.03 17.28 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.746 0.307 . . . . 0.0 110.889 179.818 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 15.8 m -134.55 157.8 41.45 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.247 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.173 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.408 ' CG1' ' N ' ' A' ' 78' ' ' GLY . 70.8 t -136.8 156.83 35.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.302 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . 0.657 ' N ' HH12 ' A' ' 71' ' ' ARG . . . -133.29 132.74 6.64 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.856 -0.898 . . . . 0.0 110.856 179.344 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 8.8 t70 . . . . . 0 N--CA 1.465 0.278 0 CA-C-O 120.891 0.377 . . . . 0.0 110.467 179.857 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 97.9 t . . . . . 0 CA--C 1.523 -0.086 0 CA-C-O 120.722 0.296 . . . . 0.0 110.414 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 87.0 m-85 -95.52 127.58 41.67 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.38 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 34.5 p -150.15 165.72 32.0 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 116.195 -0.457 . . . . 0.0 109.867 -179.038 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.553 ' CD2' ' N ' ' A' ' 89' ' ' LEU . 2.5 mm? -67.82 146.52 53.61 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.561 -179.093 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.473 ' C ' ' CD1' ' A' ' 90' ' ' TYR . 16.4 t80 -58.27 -50.03 75.03 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.446 -179.515 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.527 ' OD1' ' N ' ' A' ' 92' ' ' THR . 53.7 t0 -101.0 155.6 17.88 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.473 -179.644 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' THR . . . . . 0.527 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 62.8 p -92.99 -24.34 18.39 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 121.104 0.478 . . . . 0.0 110.576 179.503 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -57.47 -47.94 80.52 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.221 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 8.0 p -55.05 -44.78 75.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.243 -0.435 . . . . 0.0 109.857 -179.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -56.0 -41.94 75.64 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.039 179.638 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 9.4 tp-100 -61.74 -39.49 91.76 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.071 179.616 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 13.5 tp -60.36 -43.51 96.44 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.153 -0.476 . . . . 0.0 109.92 -179.597 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -64.25 -37.18 86.57 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.302 179.251 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . 0.532 ' OD1' ' NH1' ' A' ' 43' ' ' ARG . 97.2 m-20 -60.65 -39.89 90.0 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.186 0.517 . . . . 0.0 110.378 179.861 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -72.78 -47.24 48.33 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.391 -0.524 . . . . 0.0 110.653 179.4 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -62.66 -50.94 69.21 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.042 -179.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . 0.52 ' CG2' ' N ' ' A' ' 103' ' ' TYR . 10.7 tp -59.21 -47.13 91.34 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.412 -178.673 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' TYR . . . . . 0.52 ' N ' ' CG2' ' A' ' 102' ' ' ILE . 79.5 t80 -60.54 -39.55 88.31 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.275 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' HIS . . . . . 0.482 ' CE1' ' OD2' ' B' ' 210' ' ' ASP . 0.9 OUTLIER -61.19 -41.66 97.19 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.728 179.601 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 33.3 t -73.56 -38.68 65.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.808 179.645 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -64.78 -34.58 78.67 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.637 -179.508 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 74.6 t60 . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.66 -179.807 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 95.1 m-20 . . . . . 0 C--O 1.235 0.321 0 CA-C-O 121.054 0.454 . . . . 0.0 110.384 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 90.9 p -58.81 -34.13 71.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.39 -179.633 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -67.05 -49.04 66.46 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.377 179.582 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 138' ' ' ALA . . . . . . . . . . . . . . . -56.87 -36.76 70.44 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 120.845 -0.342 . . . . 0.0 110.232 -179.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -66.22 -53.41 37.47 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.498 179.415 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -59.75 -46.02 90.43 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.907 -179.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 65.2 tt0 -58.14 -51.08 71.19 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.278 0.561 . . . . 0.0 110.385 -179.777 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 142' ' ' VAL . . . . . . . . . . . . . 70.8 t -61.66 -44.96 99.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.992 179.703 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -57.36 -42.6 82.34 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 74.9 m -57.36 -44.11 84.09 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 179.823 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 19.7 m -63.99 -48.52 76.09 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.639 179.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 80.3 mt -63.69 -22.55 66.96 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.498 -179.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 147' ' ' GLN . . . . . . . . . . . . . 58.8 tt0 -75.21 -58.43 3.28 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.679 179.374 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -59.96 -54.32 47.51 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.91 -179.308 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.551 ' O ' ' O ' ' B' ' 150' ' ' ALA . 3.9 mm? -48.65 -30.89 5.95 Favored 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 -179.076 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 150' ' ' ALA . . . . . 0.551 ' O ' ' O ' ' B' ' 149' ' ' LEU . . . -56.37 -134.47 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 120.465 -0.494 . . . . 0.0 110.52 179.175 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 151' ' ' THR . . . . . 0.493 ' O ' ' O ' ' B' ' 150' ' ' ALA . 12.3 p 53.62 115.83 0.01 OUTLIER Pre-proline 0 C--N 1.32 -0.677 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.779 -179.804 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_exo -49.07 -44.27 33.47 Favored 'Trans proline' 0 N--CA 1.497 1.701 0 C-N-CA 122.118 1.879 . . . . 0.0 112.991 -179.742 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 6.9 t -59.11 -46.21 88.9 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.94 -178.859 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 154' ' ' ARG . . . . . 0.488 ' CB ' ' HG1' ' B' ' 151' ' ' THR . 16.0 tpp180 -62.96 -36.8 84.67 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.425 -179.715 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 155' ' ' LEU . . . . . 0.437 ' CD2' ' O ' ' B' ' 149' ' ' LEU . 1.9 mm? -62.88 -54.11 43.81 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.384 -0.526 . . . . 0.0 110.821 -179.09 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 156' ' ' MET . . . . . 0.455 ' O ' ' OG1' ' B' ' 159' ' ' THR . 0.0 OUTLIER -57.72 -49.34 76.89 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.063 -0.655 . . . . 0.0 110.614 -179.416 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 39.0 mm -62.63 -42.71 97.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-O 121.218 0.533 . . . . 0.0 110.337 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 48.6 tp -62.22 -43.03 99.74 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.769 -179.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 159' ' ' THR . . . . . 0.455 ' OG1' ' O ' ' B' ' 156' ' ' MET . 23.4 p -60.52 -37.08 80.0 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.913 -0.403 . . . . 0.0 109.913 -179.455 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 75.7 mt-30 -62.71 -46.13 89.57 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.256 -0.577 . . . . 0.0 110.037 179.142 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 161' ' ' LEU . . . . . . . . . . . . . 98.2 mt -64.79 -42.87 94.72 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 120.786 -0.365 . . . . 0.0 110.908 179.63 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 162' ' ' ARG . . . . . 0.525 ' NH1' ' OD1' ' B' ' 218' ' ' ASP . 68.4 ttp85 -51.73 -18.24 1.17 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.395 -179.799 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 61.1 t30 -75.26 -75.05 0.18 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.676 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . -178.42 -141.99 4.55 Favored Glycine 0 CA--C 1.534 1.225 0 C-N-CA 120.487 -0.863 . . . . 0.0 111.199 -179.65 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -49.25 132.77 29.22 Favored 'Trans proline' 0 N--CA 1.493 1.477 0 C-N-CA 122.149 1.899 . . . . 0.0 112.338 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -138.3 67.48 46.37 Favored Pre-proline 0 CA--C 1.536 0.416 0 CA-C-O 121.558 0.694 . . . . 0.0 111.362 -179.856 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -51.97 147.93 24.79 Favored 'Trans proline' 0 C--N 1.298 -2.082 0 C-N-CA 121.772 1.648 . . . . 0.0 111.347 178.24 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . 22.1 t -53.17 -50.39 46.46 Favored 'Isoleucine or valine' 0 C--O 1.237 0.417 0 CA-C-O 121.162 0.505 . . . . 0.0 110.556 -178.296 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 169' ' ' THR . . . . . . . . . . . . . 59.1 p -63.97 -37.8 88.73 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.477 179.274 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -63.57 -41.2 98.4 Favored 'General case' 0 CA--C 1.513 -0.455 0 CA-C-O 121.249 0.547 . . . . 0.0 109.987 179.191 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 171' ' ' LEU . . . . . 0.45 ' C ' ' CD1' ' B' ' 171' ' ' LEU . 2.8 tm? -61.95 -46.83 87.58 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 119.706 -0.798 . . . . 0.0 109.96 -179.628 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 172' ' ' ALA . . . . . 0.513 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -52.49 -47.85 66.31 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 120.558 -0.457 . . . . 0.0 109.955 179.441 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 44.7 tp10 -54.81 -48.5 72.7 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.425 -0.51 . . . . 0.0 110.531 179.669 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -56.32 -54.93 39.59 Favored 'General case' 0 C--O 1.232 0.157 0 C-N-CA 120.581 -0.448 . . . . 0.0 110.959 -179.352 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 175' ' ' ILE . . . . . 0.409 HD13 HG22 ' B' ' 175' ' ' ILE . 96.3 mt -88.89 -73.91 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.398 179.706 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 176' ' ' GLY . . . . . 0.513 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 132.24 97.53 0.69 Allowed Glycine 0 CA--C 1.523 0.534 0 N-CA-C 111.405 -0.678 . . . . 0.0 111.405 179.824 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 78.3 mtm 58.09 78.06 0.26 Allowed 'General case' 0 CA--C 1.521 -0.148 0 C-N-CA 121.04 -0.264 . . . . 0.0 110.947 179.141 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -174.19 32.23 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.02 0.438 . . . . 0.0 110.115 179.676 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 179' ' ' GLN . . . . . 0.54 ' H ' ' CD ' ' B' ' 179' ' ' GLN . 0.0 OUTLIER -82.21 -25.68 33.98 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.514 -179.017 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 180' ' ' SER . . . . . 0.526 ' O ' ' ND1' ' B' ' 184' ' ' HIS . 34.3 m -65.49 -42.98 91.57 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.589 -179.916 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -69.0 -36.91 78.34 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.633 179.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 54.5 t -69.8 -51.84 36.97 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.279 0 C-N-CA 120.501 -0.48 . . . . 0.0 110.785 179.791 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 48.0 t -60.05 -44.94 94.33 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.277 -0.569 . . . . 0.0 110.583 179.606 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 184' ' ' HIS . . . . . 0.572 ' CG ' HH21 ' B' ' 187' ' ' ARG . 0.9 OUTLIER -56.92 -47.61 80.19 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.395 -179.797 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -58.42 -43.07 88.51 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.967 179.699 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -60.53 -43.96 96.58 Favored 'General case' 0 CA--C 1.511 -0.535 0 C-N-CA 120.646 -0.421 . . . . 0.0 110.558 -179.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 187' ' ' ARG . . . . . 0.572 HH21 ' CG ' ' B' ' 184' ' ' HIS . 86.9 mtm180 -61.32 -40.65 94.98 Favored 'General case' 0 C--N 1.312 -1.043 0 C-N-CA 120.46 -0.496 . . . . 0.0 110.463 -180.0 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 97.3 t -59.15 -52.36 61.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 C-N-CA 120.352 -0.539 . . . . 0.0 109.701 -179.533 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 10.9 mp -67.18 -31.81 72.46 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.954 0.407 . . . . 0.0 110.341 179.078 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 190' ' ' ARG . . . . . 0.656 HH12 ' N ' ' B' ' 197' ' ' GLY . 9.6 tpt180 -54.44 -43.49 71.65 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.867 -179.137 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 10.9 m120 -61.0 -43.59 98.67 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.329 -0.549 . . . . 0.0 110.283 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 192' ' ' LEU . . . . . . . . . . . . . 10.7 mt -64.75 -39.09 93.05 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.948 0.404 . . . . 0.0 110.359 179.815 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 99.12 35.43 4.78 Favored Glycine 0 CA--C 1.524 0.621 0 N-CA-C 111.056 -0.818 . . . . 0.0 111.056 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 17.5 mt -98.7 -18.43 18.04 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.866 0.365 . . . . 0.0 110.773 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 14.1 m -134.39 157.75 41.6 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.268 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.003 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 196' ' ' VAL . . . . . 0.437 ' CG1' ' N ' ' B' ' 197' ' ' GLY . 60.8 t -137.98 158.06 32.77 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.239 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.265 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 197' ' ' GLY . . . . . 0.656 ' N ' HH12 ' B' ' 190' ' ' ARG . . . -135.75 132.69 6.27 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 179.37 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 9.7 t0 . . . . . 0 N--CA 1.463 0.196 0 CA-C-O 120.865 0.364 . . . . 0.0 110.572 179.763 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 89.2 t . . . . . 0 CA--C 1.522 -0.125 0 CA-C-O 120.661 0.267 . . . . 0.0 110.41 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 89.9 m-85 -94.98 127.74 41.26 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.384 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 30.4 p -150.33 165.53 32.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.879 -179.042 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 208' ' ' LEU . . . . . 0.554 ' CD2' ' N ' ' B' ' 208' ' ' LEU . 2.6 mm? -67.3 147.84 52.45 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.898 -179.186 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 209' ' ' TYR . . . . . 0.469 ' C ' ' CD1' ' B' ' 209' ' ' TYR . 17.0 t80 -59.05 -49.22 78.73 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.405 -179.662 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 210' ' ' ASP . . . . . 0.529 ' OD1' ' N ' ' B' ' 211' ' ' THR . 53.5 t0 -102.63 155.7 18.12 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.602 -179.596 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 211' ' ' THR . . . . . 0.529 ' N ' ' OD1' ' B' ' 210' ' ' ASP . 23.8 p -92.78 -24.24 18.61 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.005 0.431 . . . . 0.0 110.348 179.629 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 212' ' ' HIS . . . . . . . . . . . . . 88.3 m-70 -57.15 -48.14 79.43 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.204 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 213' ' ' VAL . . . . . 0.409 ' CG1' ' N ' ' B' ' 214' ' ' ALA . 9.6 p -55.35 -44.93 77.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 N-CA-C 109.862 -0.422 . . . . 0.0 109.862 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 214' ' ' ALA . . . . . 0.409 ' N ' ' CG1' ' B' ' 213' ' ' VAL . . . -54.98 -42.86 72.96 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.186 179.583 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 9.6 tp-100 -61.68 -39.67 92.26 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.093 179.545 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 216' ' ' LEU . . . . . . . . . . . . . 15.2 tp -59.89 -43.36 94.85 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.585 -0.446 . . . . 0.0 109.883 -179.489 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -64.32 -37.73 88.53 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.408 179.193 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 218' ' ' ASP . . . . . 0.525 ' OD1' ' NH1' ' B' ' 162' ' ' ARG . 98.6 m-20 -60.44 -39.78 88.75 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.122 0.487 . . . . 0.0 110.408 -179.735 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 219' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -72.84 -47.43 46.31 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.496 -0.482 . . . . 0.0 110.696 179.366 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -62.85 -51.11 68.3 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.888 0.375 . . . . 0.0 111.19 -179.847 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 221' ' ' ILE . . . . . 0.525 ' CG2' ' N ' ' B' ' 222' ' ' TYR . 10.9 tp -58.65 -47.13 89.69 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.363 -178.931 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 222' ' ' TYR . . . . . 0.525 ' N ' ' CG2' ' B' ' 221' ' ' ILE . 89.1 t80 -60.24 -39.7 87.64 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.258 179.863 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 223' ' ' HIS . . . . . 0.514 ' CE1' ' OD2' ' A' ' 91' ' ' ASP . 0.9 OUTLIER -60.89 -41.91 96.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.979 179.659 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 6.2 t -73.58 -38.34 65.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.923 0.392 . . . . 0.0 110.889 179.589 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 80.1 tt0 -64.82 -35.14 80.15 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.681 -179.504 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 76.6 t60 . . . . . 0 C--N 1.327 -0.388 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.649 -179.839 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 . . . . . 0 C--O 1.238 0.461 0 CA-C-O 121.321 0.581 . . . . 0.0 111.022 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 87.8 p -57.66 -33.11 67.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.271 -179.646 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 94.1 mm-40 -67.14 -50.73 60.25 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.282 179.752 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -56.05 -34.83 66.26 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.031 -179.656 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.66 -53.09 24.5 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 121.275 0.56 . . . . 0.0 110.422 179.378 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.96 -46.18 90.25 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.246 179.845 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.477 ' N ' ' OE1' ' A' ' 22' ' ' GLN . 0.9 OUTLIER -60.09 -52.26 66.13 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.037 0.446 . . . . 0.0 110.606 -179.574 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 77.5 t -62.3 -46.91 95.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 C-N-CA 120.457 -0.497 . . . . 0.0 110.06 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -50.47 -47.91 56.87 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-O 120.99 0.424 . . . . 0.0 110.224 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.5 t -59.38 -42.84 92.58 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.342 179.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 95.0 m -61.42 -51.2 69.73 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.766 -179.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.45 ' N ' ' CD1' ' A' ' 27' ' ' LEU . 7.6 mp -67.17 -22.14 65.77 Favored 'General case' 0 CA--C 1.523 -0.075 0 CA-C-O 120.763 0.316 . . . . 0.0 110.645 179.759 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -71.26 -62.48 1.39 Allowed 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.526 179.112 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -57.25 -53.68 55.42 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 120.753 -0.379 . . . . 0.0 110.591 -179.346 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.493 ' O ' ' O ' ' A' ' 31' ' ' ALA . 85.7 mt -46.54 -31.4 2.75 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.417 -178.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.493 ' O ' ' O ' ' A' ' 30' ' ' LEU . . . -57.06 -127.87 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.423 0 O-C-N 123.667 0.604 . . . . 0.0 110.339 179.522 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.43 ' O ' ' O ' ' A' ' 31' ' ' ALA . 0.5 OUTLIER 53.88 108.26 0.02 OUTLIER Pre-proline 0 CA--C 1.544 0.738 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.592 179.973 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -48.48 -56.01 3.54 Favored 'Trans proline' 0 N--CA 1.494 1.535 0 C-N-CA 122.061 1.841 . . . . 0.0 113.282 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 79.9 p -59.88 -46.19 90.1 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.097 -178.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 35.5 ttm180 -62.78 -43.4 98.91 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.426 -179.786 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.412 HD21 HH22 ' A' ' 43' ' ' ARG . 1.9 tt -61.46 -53.37 57.4 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.675 -178.785 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.57 ' CE ' HE21 ' A' ' 41' ' ' GLN . 11.0 tpt -51.55 -48.74 62.97 Favored 'General case' 0 C--O 1.242 0.66 0 C-N-CA 120.338 -0.545 . . . . 0.0 110.419 -179.788 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 96.6 mt -60.8 -46.48 96.07 Favored 'Isoleucine or valine' 0 C--O 1.243 0.72 0 CA-C-O 121.545 0.688 . . . . 0.0 110.375 -179.264 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 72.6 mt -59.98 -41.4 91.92 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.14 179.813 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 13.8 m -55.48 -43.08 75.21 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.119 179.698 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.57 HE21 ' CE ' ' A' ' 37' ' ' MET . 99.2 mm-40 -61.52 -44.21 97.47 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.401 -0.52 . . . . 0.0 110.72 179.676 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.417 ' C ' ' N ' ' A' ' 44' ' ' ASN . 13.7 tp -68.57 -44.3 74.75 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.335 -0.546 . . . . 0.0 111.323 180.0 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.412 HH22 HD21 ' A' ' 36' ' ' LEU . 89.3 mtm-85 -49.18 -17.14 0.2 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.322 -178.879 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.417 ' N ' ' C ' ' A' ' 42' ' ' LEU . 60.9 t-20 -147.06 65.22 1.16 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.086 179.795 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 159.29 82.01 0.04 OUTLIER Glycine 0 CA--C 1.529 0.937 0 N-CA-C 111.121 -0.792 . . . . 0.0 111.121 -179.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_exo -69.77 113.34 3.34 Favored 'Trans proline' 0 N--CA 1.497 1.711 0 C-N-CA 123.172 2.581 . . . . 0.0 111.061 178.786 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -167.15 158.61 10.48 Favored Pre-proline 0 C--N 1.324 -0.531 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.544 -179.171 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -62.71 -171.59 0.11 Allowed 'Trans proline' 0 N--CA 1.497 1.68 0 C-N-CA 122.667 2.245 . . . . 0.0 112.052 178.756 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.548 ' O ' ' N ' ' A' ' 52' ' ' LEU . 46.4 t -75.69 -62.99 1.13 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.353 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.509 -179.918 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.431 ' C ' ' O ' ' A' ' 49' ' ' VAL . 14.5 m -34.7 -49.32 0.41 Allowed 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 121.184 0.516 . . . . 0.0 110.597 -179.268 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -61.79 -44.32 97.12 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.275 178.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.548 ' N ' ' O ' ' A' ' 49' ' ' VAL . 1.3 tt -62.47 -38.67 90.73 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.773 -179.919 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.12 -42.02 93.86 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.047 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -62.66 -43.96 97.48 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.134 179.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.99 -54.95 22.4 Favored 'General case' 0 C--N 1.332 -0.159 0 C-N-CA 120.584 -0.446 . . . . 0.0 110.951 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.438 ' CG2' ' O ' ' A' ' 56' ' ' ILE . 6.8 tt -176.75 86.45 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.456 -0.133 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.761 -179.863 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . 0.508 ' O ' ' N ' ' A' ' 59' ' ' GLU . . . -157.6 -49.79 0.01 OUTLIER Glycine 0 CA--C 1.523 0.544 0 N-CA-C 110.425 -1.07 . . . . 0.0 110.425 178.608 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 99.6 mtp 43.0 17.86 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.747 0.308 . . . . 0.0 110.745 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.508 ' N ' ' O ' ' A' ' 57' ' ' GLY . 95.8 mt-10 -148.31 68.61 1.09 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.152 0.501 . . . . 0.0 109.725 -179.374 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 8.7 mt-30 -58.46 -36.32 73.52 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.798 -179.397 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 37.7 t -62.15 -45.35 93.81 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.777 -179.749 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -61.89 -36.22 80.64 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.293 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 94.0 t -65.41 -50.7 71.21 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 C-N-CA 120.657 -0.417 . . . . 0.0 110.587 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.4 t -57.74 -45.98 85.1 Favored 'General case' 0 C--N 1.332 -0.165 0 C-N-CA 120.722 -0.391 . . . . 0.0 110.331 -179.275 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 48.8 m170 -61.65 -48.0 82.81 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-O 121.191 0.52 . . . . 0.0 110.618 179.803 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 44.5 tt0 -61.83 -40.11 94.14 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.217 -179.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.6 tp -62.39 -43.27 99.21 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.232 -179.472 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -60.7 -42.92 98.13 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 120.827 -0.349 . . . . 0.0 110.732 -179.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 95.8 t -64.88 -54.19 32.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 C-N-CA 119.898 -0.721 . . . . 0.0 110.674 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 96.6 mt -59.48 -40.34 86.67 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 -178.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 62.2 ttp180 -57.97 -41.42 82.91 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.218 179.703 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -58.04 -48.62 79.54 Favored 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 120.596 -0.441 . . . . 0.0 110.539 -179.585 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.492 ' CD2' ' N ' ' A' ' 73' ' ' LEU . 4.0 mm? -66.36 -41.08 89.98 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.63 179.544 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 107.42 38.83 2.03 Favored Glycine 0 CA--C 1.525 0.671 0 N-CA-C 111.089 -0.805 . . . . 0.0 111.089 -179.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.422 ' N ' ' CD1' ' A' ' 75' ' ' LEU . 9.9 mp -98.86 -13.22 20.16 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 110.446 -0.205 . . . . 0.0 110.446 179.43 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 23.1 m -136.33 155.53 34.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 24.8 t -139.84 150.23 22.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.663 179.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -110.67 158.11 14.59 Favored Glycine 0 CA--C 1.523 0.552 0 N-CA-C 110.153 -1.179 . . . . 0.0 110.153 178.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 . . . . . 0 CA--C 1.515 -0.378 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 -179.922 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 15.5 m . . . . . 0 N--CA 1.467 0.394 0 CA-C-O 120.751 0.31 . . . . 0.0 110.324 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 77.5 m-85 -108.03 136.56 47.52 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.279 -179.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.642 ' HG ' ' N ' ' A' ' 89' ' ' LEU . 47.5 t -150.63 170.03 20.16 Favored 'General case' 0 CA--C 1.514 -0.439 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 -179.948 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.642 ' N ' ' HG ' ' A' ' 88' ' ' SER . 4.4 mm? -61.66 153.26 28.57 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.737 179.259 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 65.5 t80 -50.51 -45.83 56.83 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.485 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.498 ' OD2' ' CG ' ' A' ' 93' ' ' HIS . 28.3 t70 -156.88 168.41 27.55 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.937 -0.305 . . . . 0.0 110.507 179.88 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 64.1 p -68.88 -32.28 71.82 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.838 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . 0.498 ' CG ' ' OD2' ' A' ' 91' ' ' ASP . 27.3 m170 -39.46 -67.79 0.2 Allowed 'General case' 0 C--O 1.24 0.56 0 CA-C-O 121.34 0.591 . . . . 0.0 110.716 -179.9 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 57.7 t -45.73 -40.42 3.22 Favored 'Isoleucine or valine' 0 C--O 1.236 0.395 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.32 179.744 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.49 -38.09 86.04 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.31 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -60.74 -44.99 95.98 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.303 0.573 . . . . 0.0 110.028 -179.653 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.518 ' N ' ' CD1' ' A' ' 97' ' ' LEU . 6.4 mp -61.51 -46.32 90.48 Favored 'General case' 0 C--O 1.24 0.592 0 CA-C-O 121.522 0.677 . . . . 0.0 110.193 -179.467 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 17.7 mt -66.61 -33.86 76.59 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.259 179.494 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 91.7 m-20 -59.87 -42.48 93.78 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 -179.597 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -65.45 -48.68 71.85 Favored 'General case' 0 N--CA 1.462 0.149 0 N-CA-C 109.819 -0.438 . . . . 0.0 109.819 179.458 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.26 -44.82 96.63 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.946 179.439 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 5.3 mm -63.63 -46.17 95.56 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.932 -179.824 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 90.2 t80 -63.78 -50.78 67.65 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 120.711 -0.396 . . . . 0.0 110.643 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 56.7 t-80 -59.93 -33.9 72.51 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.677 -179.617 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 7.5 t -76.06 -50.37 14.93 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.866 0.365 . . . . 0.0 111.323 179.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -64.81 -22.03 66.9 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.534 -179.733 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 34.5 t60 . . . . . 0 N--CA 1.452 -0.33 0 C-N-CA 120.551 -0.46 . . . . 0.0 110.524 -179.048 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 . . . . . 0 N--CA 1.469 0.477 0 CA-C-O 121.056 0.455 . . . . 0.0 111.056 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 77.5 p -56.77 -45.66 81.96 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.176 179.237 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 95.5 mm-40 -62.56 -45.73 91.57 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.306 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 138' ' ' ALA . . . . . . . . . . . . . . . -56.64 -34.29 67.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.277 -179.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.7 -53.26 23.22 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-O 121.045 0.45 . . . . 0.0 110.419 179.394 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -60.17 -46.65 88.96 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 120.604 -0.438 . . . . 0.0 111.356 179.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 141' ' ' GLN . . . . . 0.511 ' N ' ' OE1' ' B' ' 141' ' ' GLN . 0.8 OUTLIER -59.29 -52.57 65.07 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.114 0.483 . . . . 0.0 110.767 -179.439 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 142' ' ' VAL . . . . . . . . . . . . . 96.7 t -62.05 -47.09 94.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 C-N-CA 120.395 -0.522 . . . . 0.0 110.113 -179.8 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -50.85 -47.26 60.32 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 120.931 0.396 . . . . 0.0 110.322 -179.649 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 14.4 t -59.28 -42.33 90.99 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.019 179.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 96.4 m -62.57 -51.61 66.66 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.406 -0.518 . . . . 0.0 110.806 -179.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 146' ' ' LEU . . . . . 0.423 ' N ' ' CD1' ' B' ' 146' ' ' LEU . 7.8 mp -66.24 -22.62 66.33 Favored 'General case' 0 CA--C 1.523 -0.096 0 CA-C-O 120.807 0.337 . . . . 0.0 110.653 179.602 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 147' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -70.89 -63.28 1.13 Allowed 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.593 179.262 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -56.85 -53.28 59.71 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 120.691 -0.404 . . . . 0.0 110.924 -179.297 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.494 ' O ' ' O ' ' B' ' 150' ' ' ALA . 88.9 mt -46.5 -31.0 2.47 Favored 'General case' 0 CA--C 1.511 -0.548 0 C-N-CA 120.956 -0.298 . . . . 0.0 110.503 -179.106 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 150' ' ' ALA . . . . . 0.494 ' O ' ' O ' ' B' ' 149' ' ' LEU . . . -57.57 -128.58 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.454 0 O-C-N 123.54 0.525 . . . . 0.0 110.517 179.511 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 151' ' ' THR . . . . . 0.436 ' O ' ' O ' ' B' ' 150' ' ' ALA . 0.6 OUTLIER 53.81 107.39 0.02 OUTLIER Pre-proline 0 CA--C 1.543 0.677 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.554 179.946 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -47.9 -59.25 1.32 Allowed 'Trans proline' 0 N--CA 1.494 1.533 0 C-N-CA 122.122 1.881 . . . . 0.0 113.338 -179.811 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 78.2 p -56.6 -46.6 80.78 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.055 -178.76 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 36.1 ttm180 -62.4 -43.33 99.07 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.451 179.795 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 155' ' ' LEU . . . . . . . . . . . . . 1.8 tt -61.05 -53.88 51.75 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 120.468 -0.493 . . . . 0.0 110.582 -178.733 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 156' ' ' MET . . . . . 0.552 ' CE ' HE21 ' B' ' 160' ' ' GLN . 11.0 tpt -51.16 -48.86 61.78 Favored 'General case' 0 C--O 1.24 0.584 0 C-N-CA 120.178 -0.609 . . . . 0.0 110.425 -179.741 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 157' ' ' ILE . . . . . 0.414 HG21 HD11 ' B' ' 157' ' ' ILE . 96.3 mt -59.94 -47.33 92.07 Favored 'Isoleucine or valine' 0 C--O 1.244 0.785 0 CA-C-O 121.715 0.769 . . . . 0.0 110.29 -179.417 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 75.3 mt -59.11 -41.89 89.24 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.053 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 13.6 m -54.77 -43.53 72.88 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.354 179.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 160' ' ' GLN . . . . . 0.552 HE21 ' CE ' ' B' ' 156' ' ' MET . 98.9 mm-40 -60.72 -44.68 96.32 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.393 -0.523 . . . . 0.0 110.574 179.725 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 161' ' ' LEU . . . . . . . . . . . . . 13.4 tp -68.43 -43.73 76.47 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.351 -0.54 . . . . 0.0 111.401 179.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 162' ' ' ARG . . . . . . . . . . . . . 88.5 mtm-85 -50.04 -19.63 0.77 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.355 -178.8 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 55.3 t-20 -142.89 64.81 1.35 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.057 179.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . 156.81 88.72 0.07 OUTLIER Glycine 0 CA--C 1.539 1.579 0 N-CA-C 110.978 -0.849 . . . . 0.0 110.978 179.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -77.87 113.98 3.55 Favored 'Trans proline' 0 N--CA 1.496 1.639 0 C-N-CA 122.518 2.145 . . . . 0.0 110.966 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -164.98 158.29 14.29 Favored Pre-proline 0 C--N 1.325 -0.462 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.711 -178.663 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_endo -61.08 -172.02 0.08 OUTLIER 'Trans proline' 0 N--CA 1.496 1.621 0 C-N-CA 122.871 2.381 . . . . 0.0 112.1 178.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 168' ' ' VAL . . . . . 0.554 ' O ' ' N ' ' B' ' 171' ' ' LEU . 47.1 t -75.39 -62.85 1.18 Allowed 'Isoleucine or valine' 0 C--O 1.224 -0.282 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.504 -179.786 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 169' ' ' THR . . . . . 0.423 ' C ' ' O ' ' B' ' 168' ' ' VAL . 17.3 m -34.58 -48.72 0.38 Allowed 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 121.126 0.488 . . . . 0.0 110.624 -179.157 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -62.44 -44.14 97.14 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.285 178.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 171' ' ' LEU . . . . . 0.554 ' N ' ' O ' ' B' ' 168' ' ' VAL . 1.2 tt -62.37 -39.32 92.79 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.226 0.536 . . . . 0.0 109.812 -179.819 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 172' ' ' ALA . . . . . . . . . . . . . . . -60.7 -42.29 96.91 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.328 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -62.25 -43.02 99.78 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.112 179.777 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -66.76 -54.54 21.78 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.587 -0.445 . . . . 0.0 110.931 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 175' ' ' ILE . . . . . 0.434 ' CG2' ' O ' ' B' ' 175' ' ' ILE . 8.8 tt -176.97 86.97 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.456 -0.147 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.719 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 176' ' ' GLY . . . . . 0.533 ' O ' ' N ' ' B' ' 178' ' ' GLU . . . -157.56 -49.0 0.01 OUTLIER Glycine 0 CA--C 1.522 0.471 0 N-CA-C 110.528 -1.029 . . . . 0.0 110.528 178.611 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 97.6 mtp 41.81 19.42 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.139 0 CA-C-O 120.787 0.327 . . . . 0.0 110.755 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 178' ' ' GLU . . . . . 0.533 ' N ' ' O ' ' B' ' 176' ' ' GLY . 94.3 mt-10 -150.06 67.05 0.97 Allowed 'General case' 0 CA--C 1.52 -0.195 0 CA-C-O 121.049 0.452 . . . . 0.0 109.989 -179.342 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 9.1 mt-30 -57.09 -37.28 71.67 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.863 -179.64 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 44.5 t -61.97 -45.95 91.42 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.805 -179.76 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -61.62 -36.4 80.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.404 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 95.5 t -64.91 -50.71 73.79 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 C-N-CA 120.593 -0.443 . . . . 0.0 110.656 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 12.0 t -58.31 -45.23 88.43 Favored 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.086 -178.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 46.6 m170 -61.67 -47.67 84.29 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-O 121.209 0.528 . . . . 0.0 110.656 179.591 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 43.2 tt0 -62.1 -40.21 95.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.234 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 6.9 tp -62.63 -43.2 99.4 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.404 -179.658 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -60.2 -42.8 95.86 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.754 -0.379 . . . . 0.0 110.315 179.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 73.9 t -64.69 -54.39 30.75 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.211 0 C-N-CA 119.898 -0.721 . . . . 0.0 110.558 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 98.5 mt -59.67 -40.95 89.49 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 -178.704 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 62.1 ttp180 -56.95 -42.25 79.74 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.29 179.775 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 40.6 t30 -57.03 -50.79 71.66 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.586 -0.446 . . . . 0.0 110.487 -179.671 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 192' ' ' LEU . . . . . 0.497 ' CD2' ' N ' ' B' ' 192' ' ' LEU . 3.9 mm? -64.45 -41.69 96.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.646 179.819 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 107.89 38.01 2.09 Favored Glycine 0 CA--C 1.524 0.613 0 N-CA-C 111.13 -0.788 . . . . 0.0 111.13 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 194' ' ' LEU . . . . . 0.446 ' N ' ' CD1' ' B' ' 194' ' ' LEU . 9.8 mp -97.49 -12.97 22.01 Favored 'General case' 0 N--CA 1.466 0.371 0 O-C-N 122.766 -0.255 . . . . 0.0 110.394 179.355 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 26.2 m -137.21 156.23 33.43 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.384 0 N-CA-C 109.981 -0.378 . . . . 0.0 109.981 -179.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 196' ' ' VAL . . . . . . . . . . . . . 29.9 t -141.42 152.55 19.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.451 179.583 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 197' ' ' GLY . . . . . . . . . . . . . . . -112.1 160.65 13.06 Favored Glycine 0 CA--C 1.522 0.509 0 N-CA-C 110.379 -1.088 . . . . 0.0 110.379 179.365 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 95.3 m-20 . . . . . 0 CA--C 1.515 -0.392 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 -179.997 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 12.3 m . . . . . 0 N--CA 1.468 0.435 0 CA-C-O 120.8 0.333 . . . . 0.0 110.327 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 79.7 m-85 -108.53 137.22 46.84 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.303 -179.813 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 207' ' ' SER . . . . . 0.701 ' HG ' ' H ' ' B' ' 208' ' ' LEU . 40.1 t -150.75 169.93 20.45 Favored 'General case' 0 C--O 1.222 -0.391 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 208' ' ' LEU . . . . . 0.701 ' H ' ' HG ' ' B' ' 207' ' ' SER . 4.4 mm? -62.27 153.69 29.96 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.718 179.23 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -50.51 -46.77 57.37 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.479 179.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 210' ' ' ASP . . . . . 0.523 ' OD2' ' CG ' ' B' ' 212' ' ' HIS . 31.5 t70 -156.42 166.14 34.3 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.911 0.386 . . . . 0.0 110.485 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 74.1 p -67.27 -32.09 72.87 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.622 -179.773 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 212' ' ' HIS . . . . . 0.523 ' CG ' ' OD2' ' B' ' 210' ' ' ASP . 29.9 m170 -39.46 -67.49 0.22 Allowed 'General case' 0 C--O 1.238 0.457 0 CA-C-O 121.308 0.575 . . . . 0.0 110.779 -179.936 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 59.3 t -45.99 -39.24 3.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.336 179.561 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 214' ' ' ALA . . . . . . . . . . . . . . . -62.49 -38.18 88.87 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.339 179.83 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 57.5 tt0 -60.44 -44.89 95.36 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.247 0.546 . . . . 0.0 109.994 -179.743 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 216' ' ' LEU . . . . . 0.524 ' CD1' ' N ' ' B' ' 216' ' ' LEU . 6.3 mp -61.99 -45.73 92.35 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-O 121.431 0.634 . . . . 0.0 110.39 -179.567 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 67.1 mt -66.55 -34.97 79.09 Favored 'General case' 0 C--O 1.218 -0.571 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.118 179.444 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -60.07 -42.67 95.06 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 -179.735 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 219' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -64.6 -47.79 77.3 Favored 'General case' 0 CA--C 1.52 -0.187 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 179.429 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -62.94 -44.42 96.11 Favored 'General case' 0 CA--C 1.518 -0.262 0 C-N-CA 120.643 -0.423 . . . . 0.0 111.098 179.28 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 5.2 mm -63.93 -45.68 96.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 C-N-CA 120.729 -0.388 . . . . 0.0 110.98 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 89.7 t80 -63.65 -50.35 69.65 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.564 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 223' ' ' HIS . . . . . . . . . . . . . 52.0 t-80 -60.58 -33.34 72.58 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.691 -179.721 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 10.6 t -76.4 -50.79 13.26 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.918 0.39 . . . . 0.0 111.501 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -64.34 -24.16 67.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.705 -179.793 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 32.9 t60 . . . . . 0 C--N 1.33 -0.277 0 C-N-CA 120.552 -0.459 . . . . 0.0 110.476 -179.18 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . 0.431 ' O ' ' OD1' ' A' ' 16' ' ' ASP . 66.8 t0 . . . . . 0 N--CA 1.464 0.273 0 CA-C-O 120.953 0.406 . . . . 0.0 110.769 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 83.8 p -45.25 -50.78 11.49 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.147 179.246 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -63.44 -42.18 98.66 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.078 179.739 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -57.49 -35.57 70.38 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.25 179.714 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.64 -53.47 33.69 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 110.181 -0.303 . . . . 0.0 110.181 179.573 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.46 -40.42 94.44 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.682 -179.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -61.33 -52.42 64.74 Favored 'General case' 0 C--O 1.242 0.704 0 CA-C-O 121.265 0.555 . . . . 0.0 110.48 -179.883 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 83.5 t -62.18 -46.19 97.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.052 179.616 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -52.93 -43.63 66.41 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 120.87 -0.332 . . . . 0.0 110.207 179.748 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.9 t -59.16 -43.23 92.08 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.234 -0.439 . . . . 0.0 109.927 179.879 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 97.2 m -62.43 -51.47 67.41 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 120.539 -0.464 . . . . 0.0 110.532 179.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.46 ' N ' ' CD1' ' A' ' 27' ' ' LEU . 7.5 mp -65.51 -20.46 66.35 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 116.563 -0.289 . . . . 0.0 110.68 179.61 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 58.8 tt0 -74.04 -60.99 2.01 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.504 179.577 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.68 -54.43 46.53 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.802 -179.385 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.47 ' O ' ' O ' ' A' ' 31' ' ' ALA . 4.0 mm? -47.73 -30.44 3.87 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.187 -179.205 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.47 ' O ' ' O ' ' A' ' 30' ' ' LEU . . . -58.9 -141.4 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.231 0.539 . . . . 0.0 110.453 179.661 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.407 ' O ' ' O ' ' A' ' 31' ' ' ALA . 3.3 m 59.48 115.76 0.02 OUTLIER Pre-proline 0 CA--C 1.541 0.609 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.149 -179.882 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -47.86 -53.15 7.02 Favored 'Trans proline' 0 C--N 1.31 -1.486 0 C-N-CA 122.306 2.004 . . . . 0.0 113.34 -179.068 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 78.0 p -53.01 -48.17 67.75 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.085 -178.576 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 82.8 mtp180 -67.77 -37.88 82.68 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 120.812 -0.355 . . . . 0.0 110.497 -179.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.74 -52.76 63.73 Favored 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 120.25 -0.58 . . . . 0.0 110.86 -178.289 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 5.3 ttt -62.06 -48.12 81.67 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.755 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 94.7 mt -60.63 -45.65 97.04 Favored 'Isoleucine or valine' 0 C--O 1.243 0.741 0 CA-C-O 121.328 0.585 . . . . 0.0 110.481 -179.491 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 43.9 mt -60.68 -40.63 92.85 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.319 179.524 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 19.3 m -59.32 -43.17 92.71 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.024 179.062 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 67.0 tp60 -54.97 -47.03 75.1 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-O 120.984 0.421 . . . . 0.0 109.94 179.863 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 27.9 mt -65.89 -38.47 88.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.928 179.249 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 53.8 ttp180 -54.75 -44.08 73.3 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.09 -178.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -134.27 62.09 1.66 Allowed 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.844 0.354 . . . . 0.0 110.21 179.651 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 177.18 80.24 0.05 OUTLIER Glycine 0 CA--C 1.533 1.202 0 N-CA-C 110.686 -0.966 . . . . 0.0 110.686 -179.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -77.56 104.91 1.95 Allowed 'Trans proline' 0 N--CA 1.494 1.536 0 C-N-CA 122.491 2.128 . . . . 0.0 111.861 -179.365 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -155.88 156.43 30.54 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.342 -179.414 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -65.45 175.51 4.14 Favored 'Trans proline' 0 C--N 1.308 -1.595 0 C-N-CA 122.83 2.353 . . . . 0.0 111.975 179.633 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.482 ' CG2' ' N ' ' A' ' 50' ' ' THR . 5.1 m -63.91 -43.85 97.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.383 0.611 . . . . 0.0 110.994 -179.743 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.482 ' N ' ' CG2' ' A' ' 49' ' ' VAL . 0.2 OUTLIER -58.08 -65.78 0.59 Allowed 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.359 -179.718 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.448 ' H ' HG22 ' A' ' 50' ' ' THR . 41.2 t0 -50.68 -36.49 36.14 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 -179.61 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 9.5 tt -63.12 -41.51 99.34 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.31 179.317 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.26 -42.76 99.62 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-O 120.896 0.379 . . . . 0.0 110.241 -179.573 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -62.41 -41.72 98.9 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.113 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -66.68 -52.94 39.05 Favored 'General case' 0 CA--C 1.521 -0.157 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.847 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.466 ' CG2' ' O ' ' A' ' 56' ' ' ILE . 7.7 tt -175.07 84.1 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.881 -179.871 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -167.01 -59.29 0.03 OUTLIER Glycine 0 CA--C 1.525 0.688 0 N-CA-C 110.523 -1.031 . . . . 0.0 110.523 178.684 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 70.7 mtm 54.0 29.93 10.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.867 0.365 . . . . 0.0 110.451 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.522 ' O ' ' N ' ' A' ' 61' ' ' SER . 19.9 pt-20 -163.99 39.54 0.09 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.593 -179.879 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -40.54 -22.99 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.588 179.692 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.531 ' O ' ' ND1' ' A' ' 65' ' ' HIS . 78.0 p -67.84 -42.55 81.22 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.387 179.883 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.469 ' N ' ' O ' ' A' ' 59' ' ' GLU . . . -66.23 -35.15 79.68 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.313 179.539 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 92.1 t -66.99 -47.94 80.85 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.645 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 75.4 m -60.23 -43.14 96.29 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 120.926 -0.31 . . . . 0.0 110.473 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' HIS . . . . . 0.531 ' ND1' ' O ' ' A' ' 61' ' ' SER . 35.3 m80 -63.72 -49.94 71.09 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.608 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 93.9 mt-30 -63.71 -37.65 88.15 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.315 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 5.0 tt -62.28 -44.96 95.33 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.549 179.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 19.4 mmm180 -61.92 -41.93 98.5 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.839 0.352 . . . . 0.0 110.39 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 88.9 t -62.7 -55.13 25.67 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.133 0 C-N-CA 119.993 -0.683 . . . . 0.0 110.066 -179.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 81.2 mt -60.86 -35.47 76.68 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.29 -0.414 . . . . 0.0 109.948 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -57.83 -42.03 83.5 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.361 179.843 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -59.68 -45.9 90.7 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.497 -0.481 . . . . 0.0 110.383 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.507 ' CD2' ' N ' ' A' ' 73' ' ' LEU . 3.9 mm? -67.87 -41.8 82.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.762 179.505 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 109.76 91.77 2.15 Favored Glycine 0 CA--C 1.522 0.531 0 N-CA-C 110.953 -0.859 . . . . 0.0 110.953 -179.66 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 55.2 tp -156.84 -25.81 0.09 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.755 0.312 . . . . 0.0 110.577 179.401 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 19.2 m -136.98 158.82 36.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.46 179.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.411 ' CG1' ' N ' ' A' ' 78' ' ' GLY . 71.5 t -143.85 157.33 16.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.393 -179.761 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . 0.411 ' N ' ' CG1' ' A' ' 77' ' ' VAL . . . -124.22 143.4 14.77 Favored Glycine 0 N--CA 1.462 0.382 0 N-CA-C 110.385 -1.086 . . . . 0.0 110.385 179.169 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 . . . . . 0 CA--C 1.514 -0.408 0 N-CA-C 110.024 -0.361 . . . . 0.0 110.024 -179.557 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 60.2 t . . . . . 0 N--CA 1.465 0.278 0 CA-C-O 120.864 0.364 . . . . 0.0 110.791 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 43.0 m-85 -100.38 132.9 45.5 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.298 178.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 48.2 t -150.73 170.97 17.93 Favored 'General case' 0 C--N 1.338 0.095 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.063 -179.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 47.2 mt -71.03 149.85 46.18 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.457 -179.718 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.421 ' O ' ' OD1' ' A' ' 91' ' ' ASP . 1.5 t80 -52.68 -51.34 60.65 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.485 -179.471 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.421 ' OD1' ' O ' ' A' ' 90' ' ' TYR . 98.9 m-20 -139.34 -171.15 3.06 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.412 -179.527 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 66.0 p -96.62 9.14 42.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.458 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 18.1 t-160 -52.39 -67.59 0.24 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.468 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 28.6 m -63.29 -34.35 66.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.34 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -56.46 -51.2 69.33 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.621 -179.839 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 -65.11 -42.92 93.54 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.26 179.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 14.4 tp -60.16 -46.64 89.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.169 0.509 . . . . 0.0 110.275 -179.66 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 71.2 mt -63.86 -37.98 89.4 Favored 'General case' 0 C--O 1.221 -0.415 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.251 179.515 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 66.1 t0 -59.47 -44.46 93.01 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.315 -179.705 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.445 ' O ' ' CG ' ' A' ' 104' ' ' HIS . 15.5 mm-40 -64.71 -50.22 67.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.7 -179.988 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -63.81 -40.45 96.66 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.415 -179.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 4.3 mm -63.75 -48.22 87.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.751 -179.037 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -67.11 -43.57 82.14 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.364 -179.71 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' HIS . . . . . 0.445 ' CG ' ' O ' ' A' ' 100' ' ' GLU . 58.1 m170 -62.76 -41.01 99.02 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.613 -179.422 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 23.3 t -76.21 -42.39 46.26 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.888 0.375 . . . . 0.0 110.923 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 85.0 tt0 -62.89 -28.8 70.29 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.547 -179.615 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 84.8 t60 . . . . . 0 C--N 1.331 -0.222 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.193 -179.073 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 135' ' ' ASP . . . . . 0.42 ' O ' ' OD1' ' B' ' 135' ' ' ASP . 67.7 t0 . . . . . 0 N--CA 1.464 0.269 0 CA-C-O 121.003 0.43 . . . . 0.0 110.668 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 57.4 p -45.55 -50.82 12.69 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.252 179.107 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -63.94 -42.52 97.3 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.074 179.681 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 138' ' ' ALA . . . . . . . . . . . . . . . -56.74 -35.61 68.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.207 179.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -66.69 -52.83 40.21 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 179.37 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -61.48 -40.33 94.14 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.71 -179.676 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -61.79 -52.02 65.92 Favored 'General case' 0 C--O 1.242 0.665 0 CA-C-O 121.233 0.54 . . . . 0.0 110.53 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 142' ' ' VAL . . . . . . . . . . . . . 90.3 t -62.18 -46.12 97.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.024 179.611 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -52.89 -43.26 66.04 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 120.86 0.362 . . . . 0.0 110.256 179.693 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 11.6 t -59.47 -43.34 93.26 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.006 179.782 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 26.7 m -62.87 -50.98 68.78 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 120.586 -0.446 . . . . 0.0 110.589 179.466 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 146' ' ' LEU . . . . . 0.45 ' N ' ' CD1' ' B' ' 146' ' ' LEU . 7.7 mp -65.86 -20.56 66.28 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.69 -0.232 . . . . 0.0 110.773 179.643 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 147' ' ' GLN . . . . . . . . . . . . . 59.3 tt0 -74.51 -59.79 2.57 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.604 179.434 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -60.43 -55.05 38.24 Favored 'General case' 0 CA--C 1.522 -0.117 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.8 -179.263 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 149' ' ' LEU . . . . . 0.462 ' O ' ' O ' ' B' ' 150' ' ' ALA . 3.9 mm? -47.62 -29.53 3.0 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.239 -179.341 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 150' ' ' ALA . . . . . 0.462 ' O ' ' O ' ' B' ' 149' ' ' LEU . . . -59.33 -143.51 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.203 0.525 . . . . 0.0 110.308 179.422 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 151' ' ' THR . . . . . . . . . . . . . 2.6 m 61.67 116.06 0.02 OUTLIER Pre-proline 0 C--N 1.322 -0.602 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.167 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_exo -48.4 -52.0 9.2 Favored 'Trans proline' 0 C--N 1.31 -1.496 0 C-N-CA 122.319 2.013 . . . . 0.0 113.364 -179.011 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 78.0 p -54.64 -48.4 72.31 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.027 -178.43 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 82.3 mtp180 -67.17 -37.73 84.22 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 120.853 -0.339 . . . . 0.0 110.588 -179.824 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 155' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.73 -53.39 57.95 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 120.431 -0.508 . . . . 0.0 110.802 -178.491 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 4.5 ttt -61.06 -47.14 87.71 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.782 -179.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 96.1 mt -61.47 -44.56 98.77 Favored 'Isoleucine or valine' 0 C--O 1.243 0.749 0 CA-C-O 121.399 0.618 . . . . 0.0 110.356 -179.574 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 33.7 mt -61.89 -40.13 94.35 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.151 179.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 16.2 m -60.47 -41.53 94.34 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.055 -0.521 . . . . 0.0 109.829 179.386 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 68.2 tp60 -57.06 -46.86 82.13 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.918 179.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 161' ' ' LEU . . . . . . . . . . . . . 32.6 mt -66.26 -38.6 88.22 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.836 179.376 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 162' ' ' ARG . . . . . . . . . . . . . 55.9 ttp180 -55.12 -43.76 74.39 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.226 -178.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -134.67 64.59 1.59 Allowed 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.948 0.404 . . . . 0.0 110.204 179.704 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . 173.8 77.58 0.05 OUTLIER Glycine 0 CA--C 1.531 1.037 0 N-CA-C 110.774 -0.931 . . . . 0.0 110.774 -179.762 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -75.35 106.4 2.26 Favored 'Trans proline' 0 N--CA 1.494 1.536 0 C-N-CA 122.547 2.165 . . . . 0.0 111.677 -179.541 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -158.41 154.45 23.58 Favored Pre-proline 0 C--N 1.325 -0.5 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.425 -179.342 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -64.6 176.89 2.51 Favored 'Trans proline' 0 C--N 1.309 -1.52 0 C-N-CA 122.834 2.356 . . . . 0.0 112.218 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 168' ' ' VAL . . . . . 0.492 ' CG2' ' N ' ' B' ' 169' ' ' THR . 4.3 m -67.51 -45.52 85.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.885 -179.815 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 169' ' ' THR . . . . . 0.492 ' N ' ' CG2' ' B' ' 168' ' ' VAL . 0.0 OUTLIER -57.63 -41.35 81.17 Favored 'General case' 0 C--O 1.246 0.9 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.349 -179.632 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 38.0 t0 -72.67 -37.81 67.81 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.527 178.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 8.6 tt -64.39 -38.41 90.92 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.171 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 172' ' ' ALA . . . . . . . . . . . . . . . -63.81 -45.31 90.2 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.264 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -60.91 -42.37 97.93 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.342 -0.543 . . . . 0.0 110.292 179.67 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -67.7 -52.28 39.61 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.927 -179.463 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 175' ' ' ILE . . . . . 0.434 ' CG2' ' O ' ' B' ' 175' ' ' ILE . 4.8 tt -174.57 85.7 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.771 -179.745 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . -168.71 -61.38 0.03 OUTLIER Glycine 0 C--N 1.315 -0.596 0 N-CA-C 110.527 -1.029 . . . . 0.0 110.527 178.532 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 64.5 mtm 56.17 29.61 15.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.792 0.329 . . . . 0.0 110.492 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 178' ' ' GLU . . . . . 0.525 ' O ' ' N ' ' B' ' 180' ' ' SER . 20.8 pt-20 -163.19 39.93 0.1 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.625 -179.816 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -40.75 -22.4 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.561 179.738 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 180' ' ' SER . . . . . 0.525 ' N ' ' O ' ' B' ' 178' ' ' GLU . 77.3 p -68.41 -42.68 78.65 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.383 179.686 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 181' ' ' ALA . . . . . 0.478 ' N ' ' O ' ' B' ' 178' ' ' GLU . . . -66.16 -35.56 80.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.348 179.556 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 99.0 t -66.96 -48.07 80.53 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.643 179.884 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 69.6 m -60.02 -43.44 95.27 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.841 0.353 . . . . 0.0 110.517 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 184' ' ' HIS . . . . . 0.512 ' ND1' ' O ' ' B' ' 180' ' ' SER . 33.8 m80 -63.37 -50.27 70.56 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-O 121.155 0.502 . . . . 0.0 110.739 -179.817 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 -63.62 -36.83 85.11 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.41 179.667 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 5.6 tt -62.47 -44.51 96.23 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.548 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 19.0 mmm180 -62.73 -42.15 99.52 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.863 0.363 . . . . 0.0 110.412 -179.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 71.5 t -62.13 -55.5 23.68 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 C-N-CA 119.989 -0.684 . . . . 0.0 110.066 -179.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 83.8 mt -60.67 -34.78 74.83 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.809 -0.441 . . . . 0.0 109.809 -179.629 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 76.3 ttt180 -58.13 -42.12 85.15 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.43 179.783 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -60.42 -46.47 89.91 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.582 -0.447 . . . . 0.0 110.445 -179.867 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 192' ' ' LEU . . . . . 0.497 ' CD2' ' N ' ' B' ' 192' ' ' LEU . 3.9 mm? -66.97 -41.69 86.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.658 179.56 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 109.14 93.38 2.27 Favored Glycine 0 CA--C 1.522 0.471 0 N-CA-C 110.85 -0.9 . . . . 0.0 110.85 -179.631 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 52.3 tp -158.83 -25.27 0.08 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.845 0.355 . . . . 0.0 110.542 179.491 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 24.1 m -137.95 159.82 33.35 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.346 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.407 179.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 196' ' ' VAL . . . . . 0.436 ' CG1' ' N ' ' B' ' 197' ' ' GLY . 73.8 t -145.35 159.16 13.13 Favored 'Isoleucine or valine' 0 C--O 1.232 0.137 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.361 -179.873 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 197' ' ' GLY . . . . . 0.436 ' N ' ' CG1' ' B' ' 196' ' ' VAL . . . -125.97 143.41 14.41 Favored Glycine 0 N--CA 1.463 0.45 0 N-CA-C 110.463 -1.055 . . . . 0.0 110.463 179.34 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 95.1 m-20 . . . . . 0 CA--C 1.514 -0.406 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 -179.57 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 62.2 t . . . . . 0 N--CA 1.463 0.213 0 CA-C-O 120.841 0.353 . . . . 0.0 110.63 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 46.5 m-85 -100.8 132.63 46.1 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.205 178.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 43.2 t -150.97 171.12 17.79 Favored 'General case' 0 C--O 1.231 0.093 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.197 -179.741 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . 41.7 mt -70.59 150.84 45.65 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.384 -179.576 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -53.85 -51.76 62.55 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.657 -0.417 . . . . 0.0 110.462 -179.63 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -138.87 -174.86 3.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.273 -179.372 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 68.2 p -92.6 7.99 40.96 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.451 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 212' ' ' HIS . . . . . . . . . . . . . 18.8 t-160 -51.11 -68.38 0.17 Allowed 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.039 0.447 . . . . 0.0 110.47 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 25.1 m -62.9 -32.87 57.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.295 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 214' ' ' ALA . . . . . . . . . . . . . . . -58.05 -50.37 73.68 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.594 -179.812 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -65.59 -43.17 90.54 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.212 179.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 216' ' ' LEU . . . . . . . . . . . . . 15.1 tp -60.24 -46.1 90.96 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.339 -179.526 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 79.3 mt -64.13 -38.55 91.46 Favored 'General case' 0 C--O 1.221 -0.406 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.332 179.373 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 63.9 t0 -59.45 -45.01 92.81 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.477 -179.879 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 219' ' ' GLU . . . . . 0.434 ' O ' ' CG ' ' B' ' 223' ' ' HIS . 15.8 mm-40 -64.23 -49.94 69.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.531 -179.921 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -63.9 -40.97 97.73 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.328 -179.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 3.7 mm -63.45 -49.11 84.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 C-N-CA 120.639 -0.424 . . . . 0.0 110.764 -179.004 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -65.52 -44.56 86.55 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.836 0.351 . . . . 0.0 110.321 -179.799 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 223' ' ' HIS . . . . . 0.434 ' CG ' ' O ' ' B' ' 219' ' ' GLU . 62.3 m170 -61.81 -41.58 97.94 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.584 -179.485 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 5.5 t -75.07 -42.59 56.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.864 0.364 . . . . 0.0 111.153 179.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 80.0 tt0 -63.48 -26.86 68.91 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.462 -179.426 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 85.4 t60 . . . . . 0 C--N 1.331 -0.199 0 C-N-CA 120.721 -0.391 . . . . 0.0 110.054 -179.032 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.31 0 N-CA-C 109.494 -1.442 . . . . 0.0 109.494 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 23.5 m-70 -66.5 -39.03 88.49 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.784 0.326 . . . . 0.0 110.525 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 83.77 177.45 51.6 Favored Glycine 0 CA--C 1.523 0.552 0 N-CA-C 110.656 -0.978 . . . . 0.0 110.656 -179.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 27.1 m -135.66 161.97 37.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 120.742 0.306 . . . . 0.0 110.278 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -129.53 -19.17 3.44 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.465 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 61.61 -134.83 47.37 Favored Glycine 0 CA--C 1.524 0.61 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 89.9 mtm180 -74.31 144.44 44.52 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.701 0.286 . . . . 0.0 110.389 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.482 ' ND2' ' N ' ' A' ' 9' ' ' ASN . 0.1 OUTLIER -144.05 45.65 1.45 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.621 -179.95 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.446 ' N ' ' CD ' ' A' ' 11' ' ' PRO . 82.3 mtt85 54.5 53.59 10.11 Favored Pre-proline 0 C--N 1.331 -0.2 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.514 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.446 ' CD ' ' N ' ' A' ' 10' ' ' ARG . 36.8 Cg_endo -65.66 137.66 50.91 Favored 'Trans proline' 0 C--N 1.308 -1.599 0 C-N-CA 122.747 2.298 . . . . 0.0 111.855 -179.557 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 38.1 t -173.49 171.93 3.8 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.675 179.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 49.2 68.8 3.16 Favored Pre-proline 0 CA--C 1.53 0.205 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.565 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -71.4 160.35 48.9 Favored 'Trans proline' 0 C--N 1.31 -1.463 0 C-N-CA 122.764 2.309 . . . . 0.0 111.927 -179.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 76.0 mt -69.04 165.45 20.18 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.24 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 38.1 m-20 -97.75 -51.49 4.08 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.36 0.6 . . . . 0.0 111.088 179.293 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 96.7 p -55.88 -28.39 56.39 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.254 -179.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -70.91 -49.85 41.28 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.645 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -55.34 -41.29 72.29 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 -179.741 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.8 -53.81 48.51 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 120.493 -0.483 . . . . 0.0 110.317 179.408 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.06 -47.73 80.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.9 0.381 . . . . 0.0 110.995 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 18.5 mm100 -56.58 -51.14 69.75 Favored 'General case' 0 C--O 1.24 0.604 0 CA-C-O 121.304 0.573 . . . . 0.0 110.488 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 71.0 t -60.97 -43.12 95.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.814 179.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -50.83 -47.66 60.04 Favored 'General case' 0 C--O 1.223 -0.317 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.422 179.682 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 39.3 t -60.43 -43.15 97.08 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.084 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 21.7 m -63.34 -50.73 68.85 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.549 -0.46 . . . . 0.0 110.937 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 89.9 mt -70.13 -22.07 63.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.783 -179.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 55.3 tt0 -75.81 -55.1 5.96 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.661 178.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.48 -55.29 35.21 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 120.616 -0.434 . . . . 0.0 110.396 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.476 ' O ' ' O ' ' A' ' 31' ' ' ALA . 86.3 mt -45.99 -32.61 2.86 Favored 'General case' 0 CA--C 1.513 -0.447 0 C-N-CA 121.052 -0.259 . . . . 0.0 110.346 -179.202 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.476 ' O ' ' O ' ' A' ' 30' ' ' LEU . . . -58.08 -126.84 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.282 179.575 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.433 ' O ' ' O ' ' A' ' 31' ' ' ALA . 0.6 OUTLIER 54.04 108.22 0.02 OUTLIER Pre-proline 0 CA--C 1.539 0.52 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.482 -179.721 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -48.77 -58.22 1.88 Allowed 'Trans proline' 0 N--CA 1.496 1.639 0 C-N-CA 122.265 1.977 . . . . 0.0 113.257 -179.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 5.4 t -57.26 -45.4 84.03 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.823 -178.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 42.6 ttm180 -57.38 -44.05 84.12 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 120.806 -0.358 . . . . 0.0 110.778 -179.513 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 10.0 mt -62.64 -44.5 96.12 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.833 -0.347 . . . . 0.0 110.638 179.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 6.9 ttt -54.08 -48.77 70.31 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 120.371 -0.532 . . . . 0.0 110.222 179.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.413 HG23 HD13 ' A' ' 38' ' ' ILE . 47.8 mm -64.87 -43.03 96.37 Favored 'Isoleucine or valine' 0 C--O 1.236 0.39 0 CA-C-O 121.302 0.572 . . . . 0.0 110.528 179.387 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.8 tt -61.6 -43.96 97.88 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.15 -179.308 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 12.0 m -59.26 -43.22 92.48 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.913 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 57.4 tp60 -55.56 -50.09 70.98 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.58 -42.92 95.3 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.96 0.886 . . . . 0.0 110.255 -179.498 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.51 ' O ' ' NE ' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -45.11 -35.79 3.31 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.389 -178.886 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 89.1 m-20 -61.29 -40.99 96.19 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.274 -179.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 167.1 170.9 32.55 Favored Glycine 0 CA--C 1.528 0.87 0 C-N-CA 120.549 -0.834 . . . . 0.0 111.25 178.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -62.6 150.49 87.59 Favored 'Trans proline' 0 N--CA 1.493 1.5 0 C-N-CA 122.733 2.289 . . . . 0.0 112.174 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 2.0 pp -175.14 145.03 0.85 Allowed Pre-proline 0 N--CA 1.449 -0.485 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.712 178.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -72.31 168.53 23.95 Favored 'Trans proline' 0 N--CA 1.498 1.742 0 C-N-CA 122.748 2.299 . . . . 0.0 112.28 178.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.439 ' CG2' ' N ' ' A' ' 50' ' ' THR . 9.0 m -63.26 -41.41 92.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.819 0.818 . . . . 0.0 110.603 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.439 ' N ' ' CG2' ' A' ' 49' ' ' VAL . 10.8 m -55.35 -41.01 71.95 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 114.756 -1.111 . . . . 0.0 110.479 179.538 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 89.2 m-20 -72.2 -42.92 65.26 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.086 0.47 . . . . 0.0 110.76 179.036 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.1 tt -61.65 -36.14 79.94 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.088 -0.505 . . . . 0.0 109.91 -179.2 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.548 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -68.61 -48.51 63.92 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 116.175 -0.466 . . . . 0.0 109.854 179.818 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -53.15 -39.65 63.7 Favored 'General case' 0 C--O 1.232 0.166 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.392 179.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.47 -40.42 95.67 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.563 179.569 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 97.6 mt -89.89 -69.7 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.519 -0.227 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.362 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . 0.548 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 150.49 74.88 0.01 OUTLIER Glycine 0 CA--C 1.523 0.56 0 C-N-CA 120.869 -0.681 . . . . 0.0 111.677 179.421 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 34.2 ttm 61.27 77.01 0.35 Allowed 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.823 0.344 . . . . 0.0 110.968 179.036 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 88.1 mt-10 -150.29 21.57 0.84 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.694 179.653 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -60.44 -29.8 69.24 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.632 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 77.9 p -70.32 -45.91 65.27 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.641 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.415 ' O ' ' OE1' ' A' ' 66' ' ' GLN . . . -63.11 -32.06 73.35 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.926 179.79 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 77.1 t -69.18 -48.13 70.46 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.131 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.518 179.458 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.415 ' HG ' ' N ' ' A' ' 65' ' ' HIS . 78.2 p -57.75 -41.88 82.82 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.642 -0.423 . . . . 0.0 110.424 -179.728 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . 0.415 ' N ' ' HG ' ' A' ' 64' ' ' SER . 52.1 m80 -67.93 -43.67 78.61 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.945 179.606 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.485 ' N ' ' OE1' ' A' ' 66' ' ' GLN . 0.7 OUTLIER -59.48 -51.62 69.09 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.022 0.439 . . . . 0.0 110.389 -179.242 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -61.51 -40.11 93.42 Favored 'General case' 0 CA--C 1.505 -0.761 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.267 -179.612 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -57.61 -44.84 85.77 Favored 'General case' 0 C--N 1.307 -1.28 0 CA-C-O 121.417 0.627 . . . . 0.0 110.446 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 90.3 t -62.29 -53.97 40.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 C-N-CA 120.248 -0.581 . . . . 0.0 110.012 -179.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.456 ' O ' ' O ' ' A' ' 74' ' ' GLY . 4.2 mm? -61.51 -31.74 71.76 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.093 0.473 . . . . 0.0 110.242 -179.791 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.665 HH12 ' H ' ' A' ' 78' ' ' GLY . 59.9 ttt85 -59.29 -41.83 89.86 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.262 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 99.2 m-20 -63.72 -37.43 87.33 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.159 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 5.8 mt -89.42 -7.08 55.89 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.458 -179.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . 0.634 ' C ' ' H ' ' A' ' 76' ' ' VAL . . . 89.56 -140.92 15.87 Favored Glycine 0 CA--C 1.521 0.43 0 N-CA-C 110.357 -1.097 . . . . 0.0 110.357 -179.814 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 38.2 mt 67.29 -29.47 0.15 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.727 0.298 . . . . 0.0 110.528 -179.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.634 ' H ' ' C ' ' A' ' 74' ' ' GLY . 3.3 m -134.34 156.67 40.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.148 179.486 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 54.7 t -137.7 146.99 26.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.367 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . 0.665 ' H ' HH12 ' A' ' 71' ' ' ARG . . . -121.47 140.92 14.25 Favored Glycine 0 C--N 1.335 0.514 0 N-CA-C 110.161 -1.176 . . . . 0.0 110.161 179.162 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 99.9 m-20 -114.37 106.43 14.3 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.9 0.381 . . . . 0.0 110.384 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 62.5 ttp180 -71.85 133.49 45.5 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.297 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -143.48 94.5 2.61 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.463 179.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 57.96 -118.63 13.64 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 110.921 -0.872 . . . . 0.0 110.921 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 17.5 ptp180 -99.04 29.67 3.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.793 0.33 . . . . 0.0 110.672 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 11.2 p -148.8 130.53 15.06 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.31 -179.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 1.1 tp -116.14 127.6 73.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 179.258 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 84.3 t -101.16 128.5 53.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.24 179.066 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 80.7 m-85 -106.37 131.63 53.36 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.384 179.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 93.7 p -150.16 170.47 18.87 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-O 120.842 0.354 . . . . 0.0 110.191 -179.486 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.554 ' CD2' ' N ' ' A' ' 89' ' ' LEU . 3.5 mm? -72.31 148.02 45.79 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.537 -179.576 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 26.4 t80 -51.7 -47.46 63.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.187 -179.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.49 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 19.7 p-10 -153.49 179.19 9.03 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.703 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 81.3 p -76.57 -17.91 58.95 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.609 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . 0.435 ' CD2' ' C ' ' A' ' 93' ' ' HIS . 12.1 t-160 -38.83 -69.39 0.13 Allowed 'General case' 0 C--O 1.236 0.368 0 CA-C-O 121.015 0.436 . . . . 0.0 110.777 -179.884 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 83.0 t -51.59 -41.16 27.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.969 -179.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -56.85 -47.82 79.5 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.666 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 99.0 mm-40 -58.21 -47.81 82.33 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.122 -179.612 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 15.4 tp -59.38 -43.66 92.87 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.048 -179.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 87.1 mt -63.7 -40.37 96.62 Favored 'General case' 0 C--O 1.221 -0.427 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.433 179.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -59.02 -42.78 91.02 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.622 -179.486 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.516 ' O ' ' ND1' ' A' ' 104' ' ' HIS . 72.6 mm-40 -67.2 -48.69 67.13 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.786 -0.366 . . . . 0.0 110.764 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -64.88 -50.57 66.07 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.159 -179.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . 0.52 ' CG2' ' N ' ' A' ' 103' ' ' TYR . 0.3 OUTLIER -62.36 -45.93 97.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 C-N-CA 120.396 -0.522 . . . . 0.0 110.769 -178.687 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' TYR . . . . . 0.52 ' N ' ' CG2' ' A' ' 102' ' ' ILE . 75.3 t80 -63.01 -49.31 75.14 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.117 -178.678 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . 0.516 ' ND1' ' O ' ' A' ' 100' ' ' GLU . 23.6 m80 -63.34 -37.22 86.41 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.737 -179.84 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 5.0 t -74.95 -44.07 50.58 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.946 0.403 . . . . 0.0 111.261 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 10.2 tm-20 -69.39 -21.59 63.77 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.566 -179.636 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . 0.476 ' C ' ' HD1' ' A' ' 107' ' ' HIS . 0.3 OUTLIER -52.24 -70.31 0.09 Allowed 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.344 -179.091 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 52.7 mt -118.79 -136.21 0.34 Allowed 'General case' 0 N--CA 1.462 0.154 0 N-CA-C 109.9 -0.407 . . . . 0.0 109.9 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . 0.515 ' NE2' ' O ' ' A' ' 111' ' ' GLY . 78.6 t60 -157.67 65.76 0.48 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.675 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 73.0 mt -63.69 -42.81 97.95 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.622 -179.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . 0.515 ' O ' ' NE2' ' A' ' 109' ' ' HIS . . . -84.78 142.05 19.84 Favored Glycine 0 CA--C 1.522 0.522 0 N-CA-C 110.581 -1.008 . . . . 0.0 110.581 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -140.48 150.86 44.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.72 0.295 . . . . 0.0 110.284 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 48.3 t -136.6 91.4 2.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.459 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -72.92 142.4 47.86 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.507 179.842 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 95.7 mtt-85 -57.12 105.9 0.27 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.376 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 5.6 m-70 -72.92 149.87 90.19 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.799 -179.455 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -68.44 155.09 70.34 Favored 'Trans proline' 0 N--CA 1.493 1.456 0 C-N-CA 122.624 2.216 . . . . 0.0 112.167 179.516 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 79.7 p -60.61 -34.23 73.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.267 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -62.86 -37.64 87.68 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.484 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.756 0 CA-C-O 117.982 -1.455 . . . . 0.0 110.874 179.949 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.278 0 N-CA-C 109.463 -1.455 . . . . 0.0 109.463 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 35.0 m-70 -66.25 -39.63 89.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.779 0.323 . . . . 0.0 110.476 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 123' ' ' GLY . . . . . . . . . . . . . . . 84.36 178.9 51.52 Favored Glycine 0 CA--C 1.524 0.632 0 N-CA-C 110.725 -0.95 . . . . 0.0 110.725 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 35.8 m -135.37 163.4 35.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.762 0.315 . . . . 0.0 110.232 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 125' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -130.6 -19.88 2.97 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.533 -179.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 63.97 -133.07 40.18 Favored Glycine 0 CA--C 1.524 0.636 0 N-CA-C 110.865 -0.894 . . . . 0.0 110.865 179.8 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 127' ' ' ARG . . . . . . . . . . . . . 89.5 mtm180 -77.01 145.45 38.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.705 0.288 . . . . 0.0 110.548 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 128' ' ' ASN . . . . . 0.429 ' ND2' ' N ' ' B' ' 128' ' ' ASN . 0.1 OUTLIER -144.05 47.56 1.42 Allowed 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.582 179.993 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 129' ' ' ARG . . . . . 0.438 ' N ' ' CD ' ' B' ' 130' ' ' PRO . 82.4 mtt85 51.03 54.63 15.55 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.418 179.843 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 130' ' ' PRO . . . . . 0.438 ' CD ' ' N ' ' B' ' 129' ' ' ARG . 38.4 Cg_endo -66.61 137.76 47.24 Favored 'Trans proline' 0 N--CA 1.495 1.587 0 C-N-CA 122.681 2.254 . . . . 0.0 111.893 -179.741 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 48.2 t -173.29 169.98 4.37 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.581 179.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 132' ' ' ALA . . . . . . . . . . . . . . . 50.65 68.73 3.12 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.524 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 133' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -71.6 160.69 47.59 Favored 'Trans proline' 0 C--N 1.312 -1.387 0 C-N-CA 122.791 2.327 . . . . 0.0 111.919 -179.48 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 69.2 mt -67.63 165.02 17.91 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.351 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 36.3 m-20 -97.91 -50.81 4.28 Favored 'General case' 0 C--O 1.238 0.47 0 CA-C-O 121.283 0.563 . . . . 0.0 110.991 179.256 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 92.1 p -57.21 -28.72 63.13 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.333 -179.584 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 10.3 tp-100 -70.66 -49.59 45.68 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.66 179.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 138' ' ' ALA . . . . . . . . . . . . . . . -55.69 -40.28 72.14 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 120.705 -0.398 . . . . 0.0 109.93 -179.614 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -63.07 -53.41 54.05 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 120.547 -0.461 . . . . 0.0 110.237 179.21 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -57.24 -47.5 81.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.867 0.365 . . . . 0.0 110.86 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 20.3 mm100 -55.99 -50.98 69.34 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-O 121.278 0.561 . . . . 0.0 110.452 -179.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 142' ' ' VAL . . . . . . . . . . . . . 76.5 t -61.96 -42.95 96.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.864 179.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -50.23 -48.6 54.4 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.269 179.561 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 38.1 t -60.42 -43.53 96.67 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.168 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 27.5 m -62.57 -50.48 71.13 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 120.556 -0.458 . . . . 0.0 111.026 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 91.3 mt -70.53 -21.6 62.71 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.901 -179.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 147' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -75.24 -56.98 4.18 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.561 179.144 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -59.65 -54.69 43.52 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.441 -179.454 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.487 ' O ' ' O ' ' B' ' 150' ' ' ALA . 81.0 mt -45.74 -34.5 3.65 Favored 'General case' 0 CA--C 1.514 -0.437 0 C-N-CA 120.976 -0.29 . . . . 0.0 110.455 -178.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 150' ' ' ALA . . . . . 0.487 ' O ' ' O ' ' B' ' 149' ' ' LEU . . . -57.57 -126.04 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.225 179.582 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 151' ' ' THR . . . . . 0.435 ' O ' ' O ' ' B' ' 150' ' ' ALA . 0.6 OUTLIER 54.35 108.22 0.02 OUTLIER Pre-proline 0 C--N 1.323 -0.579 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.49 -179.596 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_exo -48.26 -60.05 1.02 Allowed 'Trans proline' 0 N--CA 1.495 1.569 0 C-N-CA 122.256 1.97 . . . . 0.0 113.389 -179.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 39.8 t -56.64 -45.3 81.68 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.825 -178.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 42.0 ttm180 -57.17 -43.5 82.65 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 120.796 -0.362 . . . . 0.0 110.624 -179.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 155' ' ' LEU . . . . . . . . . . . . . 10.0 mt -63.1 -44.22 96.3 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.809 -0.357 . . . . 0.0 110.642 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 6.3 ttt -53.69 -48.76 69.22 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.358 -0.537 . . . . 0.0 110.158 179.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 41.8 mm -64.87 -43.43 96.33 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 CA-C-O 121.278 0.561 . . . . 0.0 110.524 179.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 1.7 tt -61.48 -43.5 98.76 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.064 -179.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 17.6 m -59.38 -43.51 92.88 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.033 -0.531 . . . . 0.0 109.996 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 61.3 tp60 -55.89 -49.97 71.93 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 120.483 -0.487 . . . . 0.0 109.811 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 161' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.31 -41.83 96.63 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.733 0.778 . . . . 0.0 110.159 -179.454 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 162' ' ' ARG . . . . . 0.532 ' NE ' ' O ' ' B' ' 162' ' ' ARG . 0.0 OUTLIER -45.56 -36.4 4.63 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.261 -179.006 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -60.99 -41.64 96.89 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.214 -179.609 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . 167.61 171.85 34.05 Favored Glycine 0 CA--C 1.528 0.862 0 C-N-CA 120.582 -0.818 . . . . 0.0 111.341 178.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_exo -64.12 150.84 87.51 Favored 'Trans proline' 0 N--CA 1.494 1.508 0 C-N-CA 122.836 2.357 . . . . 0.0 112.215 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 1.8 pp -174.85 146.46 1.0 Allowed Pre-proline 0 C--N 1.326 -0.455 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.753 178.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -71.74 166.83 28.27 Favored 'Trans proline' 0 N--CA 1.495 1.614 0 C-N-CA 122.831 2.354 . . . . 0.0 112.316 178.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 168' ' ' VAL . . . . . 0.441 ' CG2' ' N ' ' B' ' 169' ' ' THR . 10.1 m -62.32 -40.9 89.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.83 0.824 . . . . 0.0 110.636 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 169' ' ' THR . . . . . 0.441 ' N ' ' CG2' ' B' ' 168' ' ' VAL . 7.4 m -56.83 -38.8 73.13 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 114.745 -1.116 . . . . 0.0 110.294 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 27.5 m-20 -71.7 -44.33 64.39 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.201 0.524 . . . . 0.0 110.335 179.346 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.06 -32.54 72.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.16 -179.498 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 172' ' ' ALA . . . . . 0.541 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -70.99 -50.09 38.13 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.86 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -52.83 -38.82 61.86 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 120.515 -0.474 . . . . 0.0 110.336 179.607 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -64.76 -41.66 95.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.64 179.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 96.7 mt -89.4 -68.94 0.64 Allowed 'Isoleucine or valine' 0 CA--C 1.521 -0.139 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.329 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 176' ' ' GLY . . . . . 0.541 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 150.18 74.38 0.01 OUTLIER Glycine 0 CA--C 1.523 0.587 0 C-N-CA 120.959 -0.639 . . . . 0.0 111.633 179.373 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 33.4 ttm 61.38 78.15 0.3 Allowed 'General case' 0 C--O 1.232 0.148 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.866 179.293 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 88.2 mt-10 -150.56 23.09 0.8 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.628 179.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -61.78 -29.24 70.01 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.452 179.808 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 180' ' ' SER . . . . . 0.446 ' O ' ' ND1' ' B' ' 184' ' ' HIS . 78.3 p -70.28 -46.74 63.72 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.891 0.377 . . . . 0.0 110.463 -179.527 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 181' ' ' ALA . . . . . 0.409 ' O ' ' OE1' ' B' ' 185' ' ' GLN . . . -63.56 -30.97 72.01 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.931 179.691 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 54.2 t -69.34 -49.32 61.59 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.199 0 CA-C-O 121.135 0.493 . . . . 0.0 110.688 179.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 183' ' ' SER . . . . . 0.474 ' HG ' ' N ' ' B' ' 184' ' ' HIS . 78.9 p -58.56 -40.61 83.53 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.653 -0.419 . . . . 0.0 110.463 -179.642 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 184' ' ' HIS . . . . . 0.474 ' N ' ' HG ' ' B' ' 183' ' ' SER . 51.4 m80 -67.92 -43.18 79.8 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.983 179.703 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 185' ' ' GLN . . . . . 0.476 ' N ' ' OE1' ' B' ' 185' ' ' GLN . 0.7 OUTLIER -60.49 -51.37 69.74 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.038 0.447 . . . . 0.0 110.491 -179.247 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -61.59 -39.65 91.97 Favored 'General case' 0 CA--C 1.506 -0.748 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.007 -179.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 15.1 tpt180 -57.91 -45.19 86.86 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-O 121.495 0.664 . . . . 0.0 110.46 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 73.9 t -62.21 -53.67 44.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 C-N-CA 120.159 -0.617 . . . . 0.0 109.96 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 189' ' ' LEU . . . . . 0.455 ' O ' ' O ' ' B' ' 193' ' ' GLY . 4.3 mm? -61.04 -31.88 71.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.09 0.472 . . . . 0.0 110.155 -179.751 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 190' ' ' ARG . . . . . 0.721 HH12 ' H ' ' B' ' 197' ' ' GLY . 60.4 ttt85 -59.61 -41.97 91.58 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.331 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 -63.57 -37.02 85.75 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 120.734 -0.386 . . . . 0.0 110.346 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 192' ' ' LEU . . . . . . . . . . . . . 5.7 mt -89.56 -8.78 51.97 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.612 -179.364 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 193' ' ' GLY . . . . . 0.618 ' C ' ' H ' ' B' ' 195' ' ' VAL . . . 91.8 -141.72 15.75 Favored Glycine 0 CA--C 1.52 0.365 0 N-CA-C 110.389 -1.084 . . . . 0.0 110.389 -179.787 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 30.6 mt 67.86 -29.82 0.16 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.759 0.314 . . . . 0.0 110.613 -179.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 195' ' ' VAL . . . . . 0.618 ' H ' ' C ' ' B' ' 193' ' ' GLY . 3.1 m -136.18 158.34 38.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.29 179.735 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 196' ' ' VAL . . . . . . . . . . . . . 77.5 t -140.99 153.7 20.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.318 179.257 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 197' ' ' GLY . . . . . 0.721 ' H ' HH12 ' B' ' 190' ' ' ARG . . . -126.04 144.17 14.92 Favored Glycine 0 N--CA 1.464 0.505 0 N-CA-C 110.362 -1.095 . . . . 0.0 110.362 179.614 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 33.9 m-20 -114.48 109.16 17.87 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 120.89 0.376 . . . . 0.0 110.614 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 61.6 ttp180 -74.17 132.64 42.4 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.447 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 200' ' ' ALA . . . . . . . . . . . . . . . -142.24 95.44 2.8 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.689 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 201' ' ' GLY . . . . . . . . . . . . . . . 57.38 -115.48 6.72 Favored Glycine 0 CA--C 1.524 0.646 0 N-CA-C 110.712 -0.955 . . . . 0.0 110.712 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 202' ' ' ARG . . . . . . . . . . . . . 17.6 ptp180 -102.61 30.82 4.42 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.764 0.316 . . . . 0.0 110.592 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 10.2 p -148.44 130.68 15.54 Favored 'General case' 0 CA--C 1.516 -0.341 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.196 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 1.5 tp -116.65 125.65 73.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.76 179.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 96.6 t -100.11 129.09 51.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.151 179.267 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -106.92 132.52 52.78 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.418 179.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 51.5 p -151.36 171.36 17.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.281 -179.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 208' ' ' LEU . . . . . 0.557 ' CD2' ' N ' ' B' ' 208' ' ' LEU . 3.5 mm? -73.62 148.52 42.78 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.814 -179.692 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 23.4 t80 -51.63 -47.81 63.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.271 -179.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 210' ' ' ASP . . . . . 0.518 ' N ' ' OD1' ' B' ' 210' ' ' ASP . 14.3 p-10 -153.07 -179.46 7.71 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.809 0.338 . . . . 0.0 110.655 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 65.1 p -77.81 -16.94 57.97 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.531 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 212' ' ' HIS . . . . . 0.412 ' NE2' ' CB ' ' A' ' 104' ' ' HIS . 11.9 t-160 -39.4 -69.63 0.12 Allowed 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.079 0.466 . . . . 0.0 110.831 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 87.0 t -50.75 -41.56 21.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.924 -179.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 214' ' ' ALA . . . . . . . . . . . . . . . -57.34 -47.2 82.19 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.918 0.389 . . . . 0.0 110.813 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -57.98 -47.39 83.13 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.138 -179.538 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 216' ' ' LEU . . . . . . . . . . . . . 14.1 tp -60.62 -43.56 97.36 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 120.449 -0.501 . . . . 0.0 110.049 -179.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 86.6 mt -63.56 -39.94 95.68 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.439 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -59.66 -42.08 92.02 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.487 -179.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 219' ' ' GLU . . . . . 0.459 ' O ' ' ND1' ' B' ' 223' ' ' HIS . 70.8 mm-40 -67.72 -49.2 63.86 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.796 -0.361 . . . . 0.0 110.742 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -63.89 -51.3 65.16 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.986 -179.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 221' ' ' ILE . . . . . 0.508 ' CG2' ' N ' ' B' ' 222' ' ' TYR . 0.2 OUTLIER -62.26 -45.91 97.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 C-N-CA 120.419 -0.512 . . . . 0.0 110.667 -178.587 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 222' ' ' TYR . . . . . 0.508 ' N ' ' CG2' ' B' ' 221' ' ' ILE . 77.1 t80 -62.52 -49.29 75.95 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.06 -178.489 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 223' ' ' HIS . . . . . 0.459 ' ND1' ' O ' ' B' ' 219' ' ' GLU . 23.8 m80 -63.76 -36.54 84.21 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.737 -179.849 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 5.6 t -75.04 -44.66 46.5 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.927 0.394 . . . . 0.0 111.354 179.792 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 11.5 tm-20 -69.58 -21.67 63.59 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.596 -179.598 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -52.03 -70.17 0.09 Allowed 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 120.581 -0.448 . . . . 0.0 110.458 -179.145 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 227' ' ' LEU . . . . . . . . . . . . . 52.9 mt -118.5 -134.08 0.33 Allowed 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 228' ' ' HIS . . . . . 0.508 ' NE2' ' O ' ' B' ' 230' ' ' GLY . 77.5 t60 -160.39 65.05 0.33 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.619 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 229' ' ' LEU . . . . . . . . . . . . . 73.1 mt -63.4 -42.19 98.77 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.765 -179.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 230' ' ' GLY . . . . . 0.508 ' O ' ' NE2' ' B' ' 228' ' ' HIS . . . -84.93 140.42 18.59 Favored Glycine 0 CA--C 1.523 0.555 0 N-CA-C 110.674 -0.97 . . . . 0.0 110.674 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 231' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -137.16 153.08 50.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.739 0.304 . . . . 0.0 110.246 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 232' ' ' SER . . . . . . . . . . . . . 45.6 t -139.11 89.16 2.33 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.582 -179.847 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 233' ' ' ASP . . . . . . . . . . . . . 97.1 m-20 -71.67 144.6 49.31 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.365 179.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 234' ' ' ARG . . . . . . . . . . . . . 95.7 mtt-85 -59.88 104.58 0.31 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.586 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 235' ' ' HIS . . . . . . . . . . . . . 4.5 m-70 -70.81 149.42 95.11 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.786 -179.394 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 236' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -67.99 154.4 72.82 Favored 'Trans proline' 0 N--CA 1.494 1.504 0 C-N-CA 122.619 2.213 . . . . 0.0 112.142 179.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 237' ' ' SER . . . . . . . . . . . . . 78.3 p -59.67 -34.18 72.52 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.271 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 238' ' ' ALA . . . . . . . . . . . . . . . -63.56 -38.48 91.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.617 179.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.726 0 CA-C-O 118.09 -1.394 . . . . 0.0 110.914 -179.958 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.297 0 N-CA-C 109.387 -1.485 . . . . 0.0 109.387 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 -130.3 141.2 50.61 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.856 0.36 . . . . 0.0 110.511 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 79.88 18.6 72.24 Favored Glycine 0 CA--C 1.521 0.411 0 N-CA-C 111.01 -0.836 . . . . 0.0 111.01 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 11.8 p -125.87 135.14 64.81 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 CA-C-O 120.897 0.38 . . . . 0.0 110.545 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -63.73 -39.31 93.97 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.466 -179.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 131.71 95.65 0.66 Allowed Glycine 0 N--CA 1.465 0.6 0 N-CA-C 110.797 -0.921 . . . . 0.0 110.797 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 85.1 mtt85 48.65 80.83 0.06 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.823 0.344 . . . . 0.0 110.496 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 85.7 m-20 -72.63 140.09 47.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.515 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 58.4 ttm-85 46.24 75.81 0.62 Allowed Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.537 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -58.17 141.76 96.77 Favored 'Trans proline' 0 C--N 1.305 -1.743 0 C-N-CA 122.639 2.226 . . . . 0.0 112.055 -179.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.8 p -82.08 172.27 13.41 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.663 179.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.58 ' N ' ' CD ' ' A' ' 14' ' ' PRO . . . -173.45 -44.77 0.0 OUTLIER Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.418 179.888 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.58 ' CD ' ' N ' ' A' ' 13' ' ' ALA . 39.3 Cg_exo -61.06 135.9 61.86 Favored 'Trans proline' 0 C--N 1.309 -1.542 0 C-N-CA 122.659 2.239 . . . . 0.0 111.735 -179.41 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.46 ' O ' ' C ' ' A' ' 16' ' ' ASP . 0.1 OUTLIER -102.19 -56.29 2.29 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.221 -179.628 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.46 ' C ' ' O ' ' A' ' 15' ' ' LEU . 9.0 m-20 -32.34 -56.69 0.33 Allowed 'General case' 0 C--O 1.234 0.245 0 O-C-N 123.359 0.412 . . . . 0.0 110.927 -178.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 11.9 t -58.22 -50.01 75.08 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.818 179.439 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.562 ' NE2' ' O ' ' A' ' 14' ' ' PRO . 75.4 mt-30 -61.41 -43.13 99.4 Favored 'General case' 0 C--O 1.221 -0.407 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.393 179.787 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -55.3 -41.33 72.2 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.296 -179.714 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.05 -54.8 21.29 Favored 'General case' 0 C--N 1.333 -0.126 0 C-N-CA 120.672 -0.411 . . . . 0.0 110.835 179.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -58.58 -50.52 73.51 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.933 179.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.415 ' OE1' ' OG ' ' B' ' 224' ' ' SER . 54.5 tt0 -53.63 -50.69 65.15 Favored 'General case' 0 C--O 1.244 0.767 0 CA-C-O 121.061 0.458 . . . . 0.0 110.502 -179.766 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.486 ' O ' ' OG1' ' A' ' 26' ' ' THR . 49.1 t -61.5 -43.62 97.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.071 -0.513 . . . . 0.0 109.818 179.271 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -53.49 -47.24 70.0 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.308 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 41.1 t -58.71 -43.66 90.17 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.508 -179.275 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.486 ' OG1' ' O ' ' A' ' 23' ' ' VAL . 12.7 p -65.45 -53.81 37.47 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 120.602 -0.439 . . . . 0.0 111.216 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.433 ' N ' ' CD1' ' A' ' 27' ' ' LEU . 8.0 mp -65.44 -23.13 66.86 Favored 'General case' 0 C--O 1.222 -0.39 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.941 -179.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 46.6 tt0 -73.11 -63.8 1.1 Allowed 'General case' 0 C--N 1.32 -0.682 0 O-C-N 123.39 0.431 . . . . 0.0 110.588 -179.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.442 ' O ' ' OG1' ' A' ' 32' ' ' THR . . . -54.94 -52.45 62.94 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.905 -179.111 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.405 ' O ' ' C ' ' A' ' 31' ' ' ALA . 4.1 mm? -53.44 -40.0 64.84 Favored 'General case' 0 CA--C 1.512 -0.516 0 C-N-CA 120.701 -0.399 . . . . 0.0 110.917 -179.636 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.587 ' O ' ' C ' ' A' ' 32' ' ' THR . . . -38.76 -73.1 0.05 Allowed 'General case' 0 CA--C 1.51 -0.59 0 O-C-N 123.637 0.585 . . . . 0.0 110.309 179.916 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.587 ' C ' ' O ' ' A' ' 31' ' ' ALA . 6.0 p -4.53 110.99 0.03 OUTLIER Pre-proline 0 CA--C 1.54 0.56 0 O-C-N 124.294 0.996 . . . . 0.0 111.134 179.241 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_exo -50.11 -45.52 32.81 Favored 'Trans proline' 0 C--N 1.303 -1.843 0 C-N-CA 122.231 1.954 . . . . 0.0 112.45 -177.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 66.7 m -56.98 -44.82 83.05 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.982 -179.105 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 77.6 mmt-85 -63.31 -38.32 90.7 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.063 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.424 ' CD1' ' O ' ' A' ' 31' ' ' ALA . 93.9 mt -64.66 -54.2 35.49 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.682 -0.407 . . . . 0.0 111.14 -179.614 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 10.7 tpt -54.34 -49.44 69.73 Favored 'General case' 0 C--O 1.239 0.539 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.394 -179.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 5.3 mm -62.77 -44.19 99.32 Favored 'Isoleucine or valine' 0 C--O 1.243 0.742 0 CA-C-O 121.22 0.533 . . . . 0.0 110.832 179.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 27.1 mt -61.41 -39.23 89.97 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.165 179.602 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 18.9 m -58.83 -40.37 83.99 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 179.554 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -60.55 -44.54 96.03 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 121.072 0.463 . . . . 0.0 110.077 179.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.497 ' O ' ' N ' ' A' ' 44' ' ' ASN . 13.8 mt -63.45 -37.94 89.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.746 179.158 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.425 ' C ' ' O ' ' A' ' 42' ' ' LEU . 77.4 ttt-85 -35.76 -30.04 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.482 -178.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.497 ' N ' ' O ' ' A' ' 42' ' ' LEU . 98.8 m-20 -65.34 -48.69 72.13 Favored 'General case' 0 C--N 1.334 -0.092 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.803 179.476 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.493 ' N ' ' O ' ' A' ' 42' ' ' LEU . . . 152.45 -79.52 0.2 Allowed Glycine 0 CA--C 1.528 0.863 0 N-CA-C 110.717 -0.953 . . . . 0.0 110.717 179.827 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -70.21 -172.88 0.67 Allowed 'Trans proline' 0 C--N 1.306 -1.692 0 C-N-CA 122.699 2.266 . . . . 0.0 111.937 179.513 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 6.8 tp -140.24 70.14 33.82 Favored Pre-proline 0 N--CA 1.454 -0.249 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.21 179.061 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_exo -62.42 91.73 0.13 Allowed 'Trans proline' 0 C--N 1.303 -1.839 0 C-N-CA 122.816 2.344 . . . . 0.0 110.973 177.442 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 55.0 t -55.91 -53.18 41.06 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 C-N-CA 120.639 -0.424 . . . . 0.0 111.62 -179.019 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.53 ' HG1' ' H ' ' A' ' 51' ' ' ASP . 29.0 p -63.07 -63.32 1.23 Allowed 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 120.894 0.378 . . . . 0.0 110.917 179.937 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.53 ' H ' ' HG1' ' A' ' 50' ' ' THR . 0.3 OUTLIER -46.14 -47.13 17.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.325 -178.723 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 68.1 mt -62.71 -38.62 91.16 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.582 179.184 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -54.13 -50.98 65.69 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.494 179.716 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.476 ' OE1' ' O ' ' A' ' 50' ' ' THR . 7.7 mp0 -63.77 -38.44 91.11 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.357 179.78 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -57.21 -61.37 2.51 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 120.365 -0.534 . . . . 0.0 111.326 -179.125 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 15.0 pt -156.89 -10.28 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.731 -179.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -61.23 -55.43 29.39 Favored Glycine 0 C--N 1.335 0.526 0 N-CA-C 110.924 -0.87 . . . . 0.0 110.924 -178.727 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 78.9 mtp 45.55 25.82 0.27 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.684 0.278 . . . . 0.0 110.475 179.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.451 ' HG2' ' H ' ' A' ' 62' ' ' ALA . 73.2 tt0 -171.73 84.5 0.08 Allowed 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 109.77 -0.455 . . . . 0.0 109.77 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -63.7 -30.38 71.49 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.249 -179.204 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 35.5 t -64.14 -36.3 83.59 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.503 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.451 ' H ' ' HG2' ' A' ' 59' ' ' GLU . . . -67.71 -33.59 75.2 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.657 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 73.6 t -73.06 -52.84 20.42 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.919 -179.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 77.4 p -58.7 -44.58 90.38 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.316 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -62.78 -50.42 71.11 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.545 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 32.5 tt0 -60.9 -39.71 90.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.395 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 48.8 tp -61.12 -43.42 98.9 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.331 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -61.51 -40.59 95.17 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.403 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 97.9 t -61.7 -54.67 31.69 Favored 'Isoleucine or valine' 0 N--CA 1.46 0.069 0 C-N-CA 120.208 -0.597 . . . . 0.0 110.398 -179.479 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 10.9 mp -61.84 -33.79 74.79 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 179.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 26.2 tpt85 -58.4 -41.91 85.98 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.356 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 99.8 m-20 -60.72 -44.15 96.97 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.238 -179.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 10.3 mt -63.87 -40.16 95.89 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.223 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 103.94 19.27 12.07 Favored Glycine 0 CA--C 1.522 0.529 0 N-CA-C 110.869 -0.893 . . . . 0.0 110.869 -179.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.3 tp -80.54 -6.01 57.59 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.034 0.445 . . . . 0.0 110.694 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 34.6 m -139.27 163.26 26.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.298 -179.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.502 ' CG1' ' N ' ' A' ' 78' ' ' GLY . 77.7 t -149.49 164.43 3.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.789 179.867 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . 0.502 ' N ' ' CG1' ' A' ' 77' ' ' VAL . . . -107.65 147.05 16.32 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 110.445 -1.062 . . . . 0.0 110.445 179.374 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -130.67 137.54 49.62 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 120.762 0.315 . . . . 0.0 110.771 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.416 ' CD ' ' N ' ' A' ' 80' ' ' ARG . 1.1 mpt_? -74.66 131.81 41.2 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.215 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.487 ' O ' ' N ' ' A' ' 83' ' ' ARG . . . -135.59 91.62 2.74 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.186 179.063 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.451 ' C ' ' O ' ' A' ' 81' ' ' ALA . . . 29.8 -91.38 0.01 OUTLIER Glycine 0 C--N 1.338 0.679 0 N-CA-C 111.872 -0.491 . . . . 0.0 111.872 179.307 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.487 ' N ' ' O ' ' A' ' 81' ' ' ALA . 85.2 mtp180 -41.99 -63.9 0.67 Allowed 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.948 -0.301 . . . . 0.0 111.311 179.762 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 67.9 m -155.84 179.93 8.74 Favored 'General case' 0 C--O 1.221 -0.408 0 CA-C-O 121.062 0.458 . . . . 0.0 110.459 -178.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 1.1 pp -88.71 152.8 3.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.072 -179.62 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 29.3 m -128.77 161.44 37.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.605 179.561 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 78.4 m-85 -98.09 131.99 44.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.3 -179.429 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 66.0 p -145.49 166.74 24.8 Favored 'General case' 0 C--O 1.224 -0.243 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.142 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 44.8 mt -65.79 145.0 56.51 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.556 -179.607 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 12.7 t80 -50.47 -47.09 57.19 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.403 -179.511 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 23.6 p30 -141.69 169.73 17.04 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.861 0.362 . . . . 0.0 110.454 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -85.71 -16.88 37.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.476 -179.756 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 -45.43 -65.02 0.6 Allowed 'General case' 0 C--O 1.237 0.429 0 CA-C-O 120.984 0.421 . . . . 0.0 110.589 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 12.5 p -48.0 -36.63 5.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.303 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.35 -37.64 88.24 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.241 179.452 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 66.5 tp60 -62.51 -47.28 84.65 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-O 121.275 0.56 . . . . 0.0 109.935 -179.595 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.524 ' N ' ' CD1' ' A' ' 97' ' ' LEU . 7.1 mp -61.56 -42.75 99.3 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 120.424 -0.511 . . . . 0.0 110.214 -179.473 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 93.8 mt -66.97 -35.25 79.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.267 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 36.3 m-20 -60.78 -42.39 97.43 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.29 -0.413 . . . . 0.0 109.993 -179.408 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.479 ' O ' ' ND1' ' A' ' 104' ' ' HIS . 82.7 mt-10 -70.43 -52.81 19.56 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.383 179.197 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -55.44 -45.81 76.79 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.627 179.563 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 5.1 mm -63.57 -44.92 98.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.87 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 89.6 t80 -63.96 -47.02 82.09 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.145 0.497 . . . . 0.0 110.61 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . 0.479 ' ND1' ' O ' ' A' ' 100' ' ' GLU . 51.8 m80 -60.62 -36.09 77.76 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.472 -179.735 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.421 ' OG ' ' OE1' ' B' ' 141' ' ' GLN . 38.9 t -76.52 -46.88 24.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.873 179.562 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -55.59 -28.21 53.77 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.359 -179.635 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 52.8 t-80 -79.57 -2.56 42.99 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.685 179.708 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 57.1 tp -154.43 104.81 2.6 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.446 179.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -173.7 43.47 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.586 179.523 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.431 ' CD1' ' N ' ' A' ' 110' ' ' LEU . 10.4 mp -62.64 -42.18 99.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.314 -179.646 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 146.38 95.72 0.18 Allowed Glycine 0 N--CA 1.461 0.333 0 N-CA-C 110.88 -0.888 . . . . 0.0 110.88 -179.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 49.5 tp -129.95 129.97 44.48 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.831 0.348 . . . . 0.0 110.634 179.719 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 11.7 t -60.63 -43.89 96.99 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.61 179.556 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . 0.434 ' O ' ' N ' ' A' ' 116' ' ' HIS . 52.3 t0 44.6 72.06 0.22 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.562 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 10.1 tpp85 -56.01 88.01 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.586 -179.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . 0.627 ' N ' ' CD ' ' A' ' 117' ' ' PRO . 0.1 OUTLIER -94.34 -42.79 0.3 Allowed Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.38 179.409 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . 0.627 ' CD ' ' N ' ' A' ' 116' ' ' HIS . 23.6 Cg_exo -63.49 146.44 92.98 Favored 'Trans proline' 0 C--N 1.304 -1.81 0 C-N-CA 122.643 2.229 . . . . 0.0 111.726 -179.719 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 8.5 m -145.2 -30.09 0.43 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.558 179.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -70.61 144.6 51.12 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.613 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.686 0 CA-C-O 117.967 -1.463 . . . . 0.0 110.877 -179.925 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.223 0 N-CA-C 109.363 -1.495 . . . . 0.0 109.363 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 -128.04 143.19 51.06 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 120.976 0.417 . . . . 0.0 110.459 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 123' ' ' GLY . . . . . . . . . . . . . . . 78.55 19.61 73.34 Favored Glycine 0 CA--C 1.52 0.38 0 N-CA-C 110.995 -0.842 . . . . 0.0 110.995 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 14.7 p -126.99 135.32 63.99 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 CA-C-O 120.897 0.379 . . . . 0.0 110.47 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 125' ' ' GLU . . . . . . . . . . . . . 72.2 mm-40 -63.69 -40.37 96.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.458 -179.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 132.35 94.2 0.58 Allowed Glycine 0 N--CA 1.464 0.551 0 N-CA-C 110.91 -0.876 . . . . 0.0 110.91 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 127' ' ' ARG . . . . . . . . . . . . . 85.4 mtt85 50.17 80.42 0.07 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.864 0.364 . . . . 0.0 110.592 179.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 128' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -72.8 140.87 47.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.439 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 129' ' ' ARG . . . . . . . . . . . . . 57.8 ttm-85 44.7 75.05 0.69 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.084 0.469 . . . . 0.0 110.499 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -59.26 145.3 98.23 Favored 'Trans proline' 0 C--N 1.305 -1.746 0 C-N-CA 122.68 2.253 . . . . 0.0 112.11 -179.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 13.2 p -81.53 176.21 9.87 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.478 179.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 132' ' ' ALA . . . . . 0.59 ' N ' ' CD ' ' B' ' 133' ' ' PRO . . . -176.18 -44.83 0.0 OUTLIER Pre-proline 0 C--N 1.325 -0.479 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.615 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 133' ' ' PRO . . . . . 0.59 ' CD ' ' N ' ' B' ' 132' ' ' ALA . 31.8 Cg_exo -58.42 140.71 95.65 Favored 'Trans proline' 0 C--N 1.308 -1.601 0 C-N-CA 122.593 2.195 . . . . 0.0 111.747 -178.732 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -116.39 10.57 14.72 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.347 179.875 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -95.44 -59.56 1.85 Allowed 'General case' 0 C--O 1.238 0.476 0 CA-C-O 121.279 0.561 . . . . 0.0 110.591 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 11.4 t -59.26 -41.35 88.59 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.248 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 137' ' ' GLN . . . . . 0.539 ' NE2' ' O ' ' B' ' 133' ' ' PRO . 77.1 mt-30 -64.86 -46.28 82.51 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.44 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 138' ' ' ALA . . . . . . . . . . . . . . . -54.5 -41.56 69.75 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.183 -179.665 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -66.14 -54.3 27.17 Favored 'General case' 0 N--CA 1.457 -0.112 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.897 179.476 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -58.38 -51.27 70.54 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.976 179.594 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 141' ' ' GLN . . . . . 0.421 ' OE1' ' OG ' ' A' ' 105' ' ' SER . 57.1 tt0 -53.43 -49.86 66.44 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-O 121.084 0.469 . . . . 0.0 110.385 -179.747 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 142' ' ' VAL . . . . . 0.458 ' O ' ' OG1' ' B' ' 145' ' ' THR . 51.2 t -61.66 -43.25 96.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.699 179.186 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -54.44 -46.52 73.28 Favored 'General case' 0 C--O 1.217 -0.62 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.307 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 40.0 t -59.01 -44.01 91.64 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.508 -179.256 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 145' ' ' THR . . . . . 0.458 ' OG1' ' O ' ' B' ' 142' ' ' VAL . 18.0 p -65.51 -53.8 37.26 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 120.619 -0.432 . . . . 0.0 111.216 179.875 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 146' ' ' LEU . . . . . 0.415 ' N ' ' CD1' ' B' ' 146' ' ' LEU . 8.2 mp -65.04 -23.11 67.09 Favored 'General case' 0 C--O 1.22 -0.453 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.016 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 147' ' ' GLN . . . . . . . . . . . . . 46.5 tt0 -73.66 -63.35 1.22 Allowed 'General case' 0 C--N 1.319 -0.741 0 O-C-N 123.364 0.415 . . . . 0.0 110.498 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 148' ' ' ALA . . . . . 0.42 ' O ' ' OG1' ' B' ' 151' ' ' THR . . . -55.19 -52.92 61.8 Favored 'General case' 0 CA--C 1.521 -0.153 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.01 -179.085 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.411 ' O ' ' C ' ' B' ' 150' ' ' ALA . 4.1 mm? -52.96 -39.87 63.27 Favored 'General case' 0 CA--C 1.514 -0.429 0 C-N-CA 120.661 -0.415 . . . . 0.0 110.943 -179.773 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 150' ' ' ALA . . . . . 0.58 ' O ' ' C ' ' B' ' 151' ' ' THR . . . -39.19 -72.87 0.05 Allowed 'General case' 0 CA--C 1.511 -0.557 0 O-C-N 123.649 0.593 . . . . 0.0 110.285 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 151' ' ' THR . . . . . 0.58 ' C ' ' O ' ' B' ' 150' ' ' ALA . 6.8 p -4.77 110.3 0.03 OUTLIER Pre-proline 0 CA--C 1.54 0.582 0 O-C-N 124.279 0.987 . . . . 0.0 111.097 179.292 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_exo -49.4 -45.08 32.05 Favored 'Trans proline' 0 C--N 1.302 -1.875 0 C-N-CA 122.192 1.928 . . . . 0.0 112.487 -177.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 53.5 m -57.3 -44.85 84.45 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.983 -179.128 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 154' ' ' ARG . . . . . 0.585 ' NH1' HE21 ' B' ' 185' ' ' GLN . 77.2 mmt-85 -63.16 -39.01 93.42 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.996 -179.704 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 155' ' ' LEU . . . . . 0.414 ' CD1' ' O ' ' B' ' 150' ' ' ALA . 94.4 mt -63.86 -54.41 35.27 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 120.733 -0.387 . . . . 0.0 111.102 -179.559 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 10.8 tpt -54.48 -49.65 69.61 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.489 -0.484 . . . . 0.0 110.461 -179.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 5.0 mm -62.21 -44.36 99.01 Favored 'Isoleucine or valine' 0 C--O 1.242 0.686 0 CA-C-O 121.328 0.585 . . . . 0.0 110.764 179.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 27.5 mt -61.81 -39.32 91.33 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.109 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 99.8 m -58.5 -40.64 83.39 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 179.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -60.73 -44.24 96.9 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 120.968 0.414 . . . . 0.0 109.927 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 161' ' ' LEU . . . . . 0.476 ' O ' ' N ' ' B' ' 163' ' ' ASN . 14.2 mt -63.72 -36.31 83.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.852 179.219 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 162' ' ' ARG . . . . . 0.421 ' C ' ' O ' ' B' ' 161' ' ' LEU . 77.4 ttt-85 -36.48 -30.63 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.471 -179.104 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 163' ' ' ASN . . . . . 0.476 ' N ' ' O ' ' B' ' 161' ' ' LEU . 96.4 m-20 -64.96 -50.25 67.15 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.834 179.81 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 164' ' ' GLY . . . . . 0.449 ' N ' ' O ' ' B' ' 161' ' ' LEU . . . 153.91 -78.01 0.2 Allowed Glycine 0 CA--C 1.528 0.891 0 N-CA-C 110.682 -0.967 . . . . 0.0 110.682 179.715 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -70.71 -171.43 0.55 Allowed 'Trans proline' 0 C--N 1.306 -1.709 0 C-N-CA 122.681 2.254 . . . . 0.0 111.96 179.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 8.7 tp -142.25 69.9 22.34 Favored Pre-proline 0 C--N 1.331 -0.217 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.084 179.208 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_exo -63.02 91.83 0.14 Allowed 'Trans proline' 0 C--N 1.303 -1.863 0 C-N-CA 122.903 2.402 . . . . 0.0 111.123 177.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . 71.0 t -55.47 -53.29 37.62 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 C-N-CA 120.629 -0.429 . . . . 0.0 111.788 -178.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 169' ' ' THR . . . . . 0.674 ' HG1' ' H ' ' B' ' 170' ' ' ASP . 23.5 p -63.01 -63.1 1.3 Allowed 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.16 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 170' ' ' ASP . . . . . 0.674 ' H ' ' HG1' ' B' ' 169' ' ' THR . 0.8 OUTLIER -48.02 -44.97 31.44 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.159 -0.473 . . . . 0.0 109.966 -177.96 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 64.5 mt -63.52 -39.79 95.36 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.681 178.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 172' ' ' ALA . . . . . . . . . . . . . . . -53.31 -50.57 64.66 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.355 179.557 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 173' ' ' GLU . . . . . 0.476 ' OE1' ' O ' ' B' ' 169' ' ' THR . 8.7 mp0 -63.51 -38.86 92.77 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.382 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -56.76 -61.86 2.14 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 120.364 -0.534 . . . . 0.0 111.23 -179.077 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 15.5 pt -156.63 -9.76 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.752 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . -61.51 -55.12 30.7 Favored Glycine 0 CA--C 1.521 0.467 0 N-CA-C 110.94 -0.864 . . . . 0.0 110.94 -178.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 76.5 mtp 45.43 26.37 0.29 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.706 0.288 . . . . 0.0 110.402 179.193 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 178' ' ' GLU . . . . . 0.412 ' HG2' ' H ' ' B' ' 181' ' ' ALA . 70.2 tt0 -172.6 85.34 0.06 Allowed 'General case' 0 CA--C 1.528 0.103 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -179.91 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -64.21 -29.84 70.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.289 -179.252 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 38.4 t -64.07 -37.74 88.54 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.534 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 181' ' ' ALA . . . . . 0.412 ' H ' ' HG2' ' B' ' 178' ' ' GLU . . . -66.71 -33.27 75.26 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.683 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 74.8 t -73.36 -53.05 19.22 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.15 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.866 -179.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 78.0 p -59.34 -44.03 92.7 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 -179.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 58.9 t-80 -63.9 -50.38 68.97 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-O 120.935 0.398 . . . . 0.0 110.653 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 185' ' ' GLN . . . . . 0.585 HE21 ' NH1' ' B' ' 154' ' ' ARG . 40.4 tt0 -61.27 -39.83 91.85 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.106 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 53.6 tp -60.92 -45.14 95.84 Favored 'General case' 0 C--O 1.222 -0.372 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.305 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -59.79 -41.66 91.67 Favored 'General case' 0 C--O 1.241 0.646 0 O-C-N 123.212 0.32 . . . . 0.0 110.415 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 88.1 t -59.26 -54.05 39.64 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.096 0 C-N-CA 120.241 -0.583 . . . . 0.0 110.076 -179.357 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 10.8 mp -62.13 -33.05 73.76 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.927 -0.398 . . . . 0.0 109.927 179.503 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -57.76 -41.41 81.88 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.26 -179.411 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -63.1 -40.48 97.77 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.425 -179.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 192' ' ' LEU . . . . . . . . . . . . . 9.1 mt -66.27 -40.12 89.9 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.469 -179.489 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 103.44 17.13 18.41 Favored Glycine 0 CA--C 1.523 0.561 0 N-CA-C 110.923 -0.871 . . . . 0.0 110.923 -179.587 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 4.5 tp -80.24 -6.16 57.4 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.965 0.412 . . . . 0.0 110.656 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 34.3 m -138.67 162.5 29.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.33 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 196' ' ' VAL . . . . . 0.503 ' CG1' ' N ' ' B' ' 197' ' ' GLY . 71.3 t -149.28 164.16 4.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 120.905 0.384 . . . . 0.0 110.787 179.777 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 197' ' ' GLY . . . . . 0.503 ' N ' ' CG1' ' B' ' 196' ' ' VAL . . . -106.92 147.47 16.22 Favored Glycine 0 CA--C 1.523 0.575 0 N-CA-C 110.428 -1.069 . . . . 0.0 110.428 179.413 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 96.7 m-20 -130.72 139.08 50.26 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 120.742 0.306 . . . . 0.0 110.579 -179.791 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 16.3 mmt85 -77.38 134.76 38.36 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.374 -179.677 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 200' ' ' ALA . . . . . 0.494 ' O ' ' N ' ' B' ' 202' ' ' ARG . . . -139.22 90.8 2.45 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.262 179.412 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 201' ' ' GLY . . . . . 0.447 ' C ' ' O ' ' B' ' 200' ' ' ALA . . . 29.66 -90.84 0.01 OUTLIER Glycine 0 CA--C 1.524 0.636 0 O-C-N 123.649 0.593 . . . . 0.0 111.772 179.232 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 202' ' ' ARG . . . . . 0.494 ' N ' ' O ' ' B' ' 200' ' ' ALA . 85.0 mtp180 -41.52 -63.62 0.68 Allowed 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 121.012 -0.275 . . . . 0.0 111.382 179.568 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 70.1 m -157.01 179.64 9.11 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.226 0.536 . . . . 0.0 110.435 -179.125 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 204' ' ' ILE . . . . . 0.411 ' CD1' ' C ' ' B' ' 204' ' ' ILE . 1.1 pp -88.86 153.16 3.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.128 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 27.4 m -128.81 161.04 38.71 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.341 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.507 179.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 78.0 m-85 -97.58 131.18 44.41 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.229 -179.476 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 14.8 p -144.57 165.94 26.58 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.337 -179.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . 34.4 mt -65.51 146.01 55.39 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.485 -179.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 13.2 t80 -50.95 -48.46 60.93 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.337 -179.532 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 22.3 p30 -140.89 169.66 17.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.947 0.403 . . . . 0.0 110.441 -179.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -85.31 -17.28 37.31 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.384 -179.867 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 212' ' ' HIS . . . . . . . . . . . . . 85.3 m-70 -44.47 -65.49 0.51 Allowed 'General case' 0 C--O 1.237 0.412 0 CA-C-O 121.03 0.443 . . . . 0.0 110.569 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 11.4 p -48.28 -35.44 5.71 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.283 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 214' ' ' ALA . . . . . . . . . . . . . . . -64.79 -38.27 90.4 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.228 179.351 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 69.2 tp60 -62.21 -46.75 87.51 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 121.202 0.525 . . . . 0.0 110.021 -179.556 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 216' ' ' LEU . . . . . 0.537 ' CD1' ' N ' ' B' ' 216' ' ' LEU . 6.8 mp -61.7 -43.54 98.67 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 120.437 -0.505 . . . . 0.0 110.239 -179.409 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 95.7 mt -66.1 -36.2 82.53 Favored 'General case' 0 C--O 1.222 -0.347 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.286 179.17 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 89.0 m-20 -59.76 -43.01 94.5 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.094 -179.434 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 219' ' ' GLU . . . . . 0.507 ' O ' ' ND1' ' B' ' 223' ' ' HIS . 96.7 mt-10 -69.57 -52.53 25.38 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.413 179.231 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -56.5 -45.53 80.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.663 179.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 5.1 mm -63.27 -45.17 99.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.761 -179.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 91.0 t80 -63.91 -46.96 82.47 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.155 0.502 . . . . 0.0 110.676 179.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 223' ' ' HIS . . . . . 0.507 ' ND1' ' O ' ' B' ' 219' ' ' GLU . 46.2 m80 -60.36 -36.44 78.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.468 -179.623 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 224' ' ' SER . . . . . 0.415 ' OG ' ' OE1' ' A' ' 22' ' ' GLN . 10.2 t -76.36 -46.61 26.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.926 0.393 . . . . 0.0 110.836 179.643 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -55.44 -28.87 56.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.326 -179.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 55.6 t-80 -79.61 -2.68 43.67 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.695 179.7 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 227' ' ' LEU . . . . . . . . . . . . . 56.6 tp -153.5 104.18 2.72 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.606 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 228' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -173.4 44.97 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.52 179.525 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 229' ' ' LEU . . . . . 0.42 ' N ' ' CD1' ' B' ' 229' ' ' LEU . 10.7 mp -62.93 -42.37 99.78 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.466 -179.874 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . 145.3 93.75 0.16 Allowed Glycine 0 N--CA 1.46 0.292 0 N-CA-C 110.869 -0.892 . . . . 0.0 110.869 -179.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 231' ' ' LEU . . . . . . . . . . . . . 45.4 tp -127.84 129.95 47.81 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.84 0.352 . . . . 0.0 110.673 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 232' ' ' SER . . . . . . . . . . . . . 11.8 t -61.13 -43.54 98.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.593 179.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 233' ' ' ASP . . . . . 0.412 ' O ' ' N ' ' B' ' 235' ' ' HIS . 53.5 t0 43.57 78.89 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.774 -179.861 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 234' ' ' ARG . . . . . . . . . . . . . 10.4 tpp85 -60.68 85.52 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 121.074 0.464 . . . . 0.0 110.362 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 235' ' ' HIS . . . . . 0.609 ' N ' ' CD ' ' B' ' 236' ' ' PRO . 0.1 OUTLIER -90.46 -43.23 0.4 Allowed Pre-proline 0 C--N 1.325 -0.472 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.049 179.169 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 236' ' ' PRO . . . . . 0.609 ' CD ' ' N ' ' B' ' 235' ' ' HIS . 57.2 Cg_endo -79.72 144.09 17.17 Favored 'Trans proline' 0 C--N 1.309 -1.518 0 C-N-CA 122.641 2.227 . . . . 0.0 111.828 -178.715 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 237' ' ' SER . . . . . . . . . . . . . 4.0 m -141.74 -22.08 0.73 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.709 179.423 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 238' ' ' ALA . . . . . . . . . . . . . . . -66.82 141.73 57.59 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.576 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.219 -0.799 0 CA-C-O 118.028 -1.429 . . . . 0.0 110.93 179.996 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.268 0 N-CA-C 109.559 -1.416 . . . . 0.0 109.559 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 88.8 m-70 -66.51 -40.05 89.01 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.829 0.347 . . . . 0.0 110.577 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -166.96 114.63 0.59 Allowed Glycine 0 CA--C 1.525 0.666 0 N-CA-C 110.692 -0.963 . . . . 0.0 110.692 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 26.8 m -134.9 162.78 38.03 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.145 0 CA-C-O 120.848 0.356 . . . . 0.0 110.268 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.484 ' CD ' ' N ' ' A' ' 6' ' ' GLU . 1.2 pm0 -133.23 132.39 41.42 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.253 -179.886 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -92.41 46.6 2.59 Favored Glycine 0 CA--C 1.523 0.573 0 N-CA-C 110.798 -0.921 . . . . 0.0 110.798 179.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 78.7 ttt-85 -64.66 135.11 55.55 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.715 0.293 . . . . 0.0 110.401 -179.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 6.8 m120 -80.42 165.41 22.24 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.563 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 57.4 mtt180 62.04 62.07 2.35 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.523 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -77.11 46.74 2.03 Favored 'Trans proline' 0 C--N 1.31 -1.483 0 C-N-CA 122.812 2.342 . . . . 0.0 112.015 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 23.8 m -70.37 145.61 51.02 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.336 179.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -160.03 72.31 3.11 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.365 179.83 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_exo -60.51 144.15 99.5 Favored 'Trans proline' 0 C--N 1.308 -1.572 0 C-N-CA 122.977 2.451 . . . . 0.0 111.727 179.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -99.92 20.57 14.08 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.088 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 90.3 m-20 -94.82 -62.04 1.39 Allowed 'General case' 0 C--O 1.236 0.353 0 CA-C-O 121.123 0.487 . . . . 0.0 110.96 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 88.5 p -61.56 -37.51 84.08 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.347 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -66.17 -47.22 74.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.336 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.426 ' O ' ' CG2' ' A' ' 23' ' ' VAL . . . -56.24 -39.76 73.05 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.701 -0.4 . . . . 0.0 110.211 -179.753 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.04 -54.05 40.34 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.54 -0.464 . . . . 0.0 110.336 179.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -58.6 -47.93 82.68 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.29 -179.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -62.09 -50.97 69.81 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.984 -179.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.426 ' CG2' ' O ' ' A' ' 19' ' ' ALA . 95.1 t -61.25 -44.52 98.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.31 -179.699 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.1 -41.13 82.86 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.198 179.559 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 69.2 m -59.64 -43.64 93.79 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.137 179.616 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 85.7 m -62.91 -47.82 81.62 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.624 -0.43 . . . . 0.0 110.757 179.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 91.6 mt -67.82 -21.47 65.21 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.501 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 55.9 tt0 -75.33 -56.48 4.67 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.618 179.457 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.48 -53.9 52.78 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.614 -179.661 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.488 ' O ' ' O ' ' A' ' 31' ' ' ALA . 87.9 mt -47.13 -35.48 7.26 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 120.756 0.312 . . . . 0.0 110.196 -179.09 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.488 ' O ' ' O ' ' A' ' 30' ' ' LEU . . . -57.89 -140.35 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.44 179.103 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.432 ' O ' ' O ' ' A' ' 31' ' ' ALA . 47.2 m 57.65 112.75 0.02 OUTLIER Pre-proline 0 CA--C 1.54 0.574 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.98 -179.726 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . 0.419 ' O ' ' N ' ' A' ' 36' ' ' LEU . 51.3 Cg_exo -48.25 -59.07 1.38 Allowed 'Trans proline' 0 N--CA 1.495 1.617 0 C-N-CA 122.211 1.94 . . . . 0.0 113.306 -179.099 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.599 ' HG ' ' H ' ' A' ' 35' ' ' ARG . 81.1 p -44.74 -48.36 10.78 Favored 'General case' 0 C--O 1.237 0.445 0 CA-C-O 121.18 0.514 . . . . 0.0 111.014 -178.66 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.599 ' H ' ' HG ' ' A' ' 34' ' ' SER . 84.2 mtp180 -72.46 -24.61 61.22 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.344 179.764 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.419 ' N ' ' O ' ' A' ' 33' ' ' PRO . 0.2 OUTLIER -67.2 -55.41 14.22 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 119.901 -0.72 . . . . 0.0 111.337 -178.542 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 5.2 ptp -64.78 -43.76 92.18 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.255 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 97.5 mt -63.12 -45.31 98.96 Favored 'Isoleucine or valine' 0 C--O 1.241 0.63 0 CA-C-O 121.415 0.626 . . . . 0.0 110.477 -179.313 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 5.3 tt -63.21 -41.23 99.11 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.599 179.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 31.7 m -59.26 -43.07 92.46 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.077 179.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 17.3 mm100 -56.85 -45.32 82.49 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.545 -0.462 . . . . 0.0 110.019 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 31.7 mt -66.5 -40.08 89.05 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.509 -0.477 . . . . 0.0 110.979 179.006 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 73.8 ttp85 -60.24 -34.2 73.35 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.682 -179.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -57.15 -40.11 76.55 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.262 -179.559 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 167.45 170.54 32.4 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 111.052 -0.819 . . . . 0.0 111.052 179.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -65.6 144.08 77.39 Favored 'Trans proline' 0 C--N 1.307 -1.624 0 C-N-CA 122.779 2.319 . . . . 0.0 111.809 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 1.9 pp -175.09 146.65 0.96 Allowed Pre-proline 0 C--N 1.325 -0.47 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.869 179.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -72.17 167.39 26.95 Favored 'Trans proline' 0 N--CA 1.495 1.566 0 C-N-CA 122.821 2.347 . . . . 0.0 112.19 179.333 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.431 ' CG2' ' N ' ' A' ' 50' ' ' THR . 3.1 m -62.38 -38.41 81.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 121.494 0.664 . . . . 0.0 110.425 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.431 ' N ' ' CG2' ' A' ' 49' ' ' VAL . 73.9 m -58.67 -44.65 90.24 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 114.526 -1.216 . . . . 0.0 110.293 179.781 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.422 ' O ' ' OD1' ' A' ' 51' ' ' ASP . 64.8 t0 -68.21 -37.2 80.63 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.923 -0.581 . . . . 0.0 109.907 178.579 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.43 ' C ' ' CD1' ' A' ' 52' ' ' LEU . 3.1 tm? -62.83 -44.34 96.41 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 119.988 -0.685 . . . . 0.0 110.25 -179.561 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.02 -43.32 99.07 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.587 179.834 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -60.19 -49.11 78.91 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 120.332 -0.547 . . . . 0.0 110.527 179.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.72 -52.35 57.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.035 -179.509 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.44 ' CG2' ' O ' ' A' ' 56' ' ' ILE . 7.6 tt -176.02 87.76 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.458 -0.073 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.941 -179.461 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -164.92 -57.17 0.02 OUTLIER Glycine 0 CA--C 1.52 0.389 0 N-CA-C 110.353 -1.099 . . . . 0.0 110.353 178.137 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 66.5 mtt 53.73 27.54 7.07 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.285 179.639 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.421 ' HG2' ' H ' ' A' ' 62' ' ' ALA . 70.6 tt0 -165.72 89.35 0.43 Allowed 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -74.1 -21.91 59.7 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.84 -179.328 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 78.1 p -67.15 -41.74 85.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.792 -179.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.421 ' H ' ' HG2' ' A' ' 59' ' ' GLU . . . -67.14 -32.12 73.03 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.473 179.78 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 83.6 t -69.99 -51.79 36.7 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.24 0 CA-C-N 116.488 -0.323 . . . . 0.0 110.778 179.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 99.3 p -60.33 -38.59 84.23 Favored 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 120.766 -0.374 . . . . 0.0 110.448 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 56.7 t-80 -66.39 -49.94 65.14 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-O 121.036 0.446 . . . . 0.0 110.703 -179.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 91.2 mm-40 -63.65 -38.01 89.51 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.242 179.658 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.5 tp -61.82 -45.27 94.54 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.002 -0.544 . . . . 0.0 109.776 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 60.9 ttt85 -60.63 -45.16 95.09 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.499 -0.48 . . . . 0.0 110.483 -179.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 85.5 t -62.74 -54.65 31.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 C-N-CA 120.093 -0.643 . . . . 0.0 110.145 -179.457 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 78.4 mt -58.64 -35.15 72.07 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.08 0.467 . . . . 0.0 110.057 -179.196 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 70.0 ttt180 -60.43 -40.54 91.41 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.304 179.515 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 40.9 t-20 -62.36 -44.03 97.43 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 120.45 -0.5 . . . . 0.0 110.483 -179.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 6.4 mt -67.88 -39.9 83.61 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.347 -179.212 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 104.66 29.0 5.48 Favored Glycine 0 CA--C 1.526 0.779 0 N-CA-C 110.808 -0.917 . . . . 0.0 110.808 -179.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 92.5 mt -90.28 -19.35 24.2 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.869 0.366 . . . . 0.0 110.838 179.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 21.8 m -135.82 158.25 39.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.097 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.416 ' CG1' ' N ' ' A' ' 78' ' ' GLY . 39.3 t -141.59 155.88 20.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.508 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . 0.416 ' N ' ' CG1' ' A' ' 77' ' ' VAL . . . -117.68 142.19 17.01 Favored Glycine 0 CA--C 1.524 0.649 0 N-CA-C 110.185 -1.166 . . . . 0.0 110.185 178.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -114.86 108.34 16.61 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 120.745 0.307 . . . . 0.0 110.311 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 60.9 ttp180 -80.89 131.68 35.38 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.796 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -142.01 120.83 12.71 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.938 0.399 . . . . 0.0 110.506 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 52.72 -117.52 6.66 Favored Glycine 0 CA--C 1.525 0.667 0 N-CA-C 110.533 -1.027 . . . . 0.0 110.533 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 52.9 ttp180 -110.34 34.09 4.12 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.257 0.551 . . . . 0.0 109.904 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 25.8 m -156.99 147.5 21.38 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 179.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -130.22 154.92 41.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.098 179.622 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.8 m -128.94 150.19 34.35 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.589 178.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 63.1 m-85 -106.81 133.64 51.16 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.061 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 74.5 m -151.23 171.71 16.98 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 64.0 mt -63.99 150.56 44.97 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.584 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -52.73 -48.65 66.52 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.398 -179.5 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 90.3 m-20 -139.71 166.92 23.32 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.078 0.466 . . . . 0.0 110.572 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 47.9 p -76.11 -24.22 54.96 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.835 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . 0.573 ' CB ' ' CE1' ' B' ' 223' ' ' HIS . 68.2 m80 -41.15 -60.12 1.32 Allowed 'General case' 0 C--O 1.237 0.416 0 CA-C-O 121.186 0.517 . . . . 0.0 110.72 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 10.8 m -55.81 -40.1 59.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.925 -0.58 . . . . 0.0 109.957 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -56.77 -41.15 77.1 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.987 0.422 . . . . 0.0 110.508 179.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.458 ' O ' ' OE1' ' A' ' 100' ' ' GLU . 6.1 tp-100 -64.76 -42.51 95.09 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.137 179.777 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 17.2 tp -59.6 -45.63 91.33 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.188 -0.605 . . . . 0.0 110.341 -178.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -65.51 -36.26 83.31 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.103 179.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 66.9 t0 -58.77 -43.17 90.33 Favored 'General case' 0 C--N 1.32 -0.706 0 C-N-CA 120.415 -0.514 . . . . 0.0 110.434 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.478 ' N ' ' OE1' ' A' ' 100' ' ' GLU . 2.7 mp0 -69.02 -50.41 49.04 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.484 179.786 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.35 -44.67 92.64 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.759 -0.376 . . . . 0.0 110.38 -179.685 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 4.8 mm -62.76 -45.04 99.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 C-N-CA 120.666 -0.414 . . . . 0.0 110.42 -179.264 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 73.2 t80 -64.09 -44.45 92.29 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.057 0.456 . . . . 0.0 110.389 179.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . 0.551 ' CE1' ' CB ' ' B' ' 212' ' ' HIS . 25.7 t60 -59.14 -39.17 81.52 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.74 179.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 12.3 t -77.04 -44.57 30.28 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.918 0.39 . . . . 0.0 111.25 179.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 79.5 tt0 -55.82 -31.1 62.39 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.472 -179.173 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -52.27 -70.76 0.08 Allowed 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.388 -0.525 . . . . 0.0 110.195 -179.214 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 50.0 mt -109.89 -142.45 0.38 Allowed 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 7.9 p80 -158.02 135.79 10.56 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.716 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.517 ' CD2' ' N ' ' A' ' 110' ' ' LEU . 3.9 mm? -63.71 -44.59 93.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.506 -179.528 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 67.55 -1.12 7.71 Favored Glycine 0 CA--C 1.526 0.74 0 N-CA-C 110.813 -0.915 . . . . 0.0 110.813 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.415 ' H ' ' C ' ' A' ' 110' ' ' LEU . 83.3 mt -77.65 -110.86 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.818 0.342 . . . . 0.0 110.548 -179.74 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 37.4 t 56.22 57.14 5.21 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.533 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -101.81 39.52 1.45 Allowed 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.538 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -71.29 127.93 34.2 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.141 179.769 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . 0.605 ' N ' ' CD ' ' A' ' 117' ' ' PRO . 0.1 OUTLIER -103.9 -43.05 0.18 Allowed Pre-proline 0 C--N 1.331 -0.222 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.473 179.757 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . 0.605 ' CD ' ' N ' ' A' ' 116' ' ' HIS . 31.9 Cg_exo -57.81 135.92 72.12 Favored 'Trans proline' 0 C--N 1.306 -1.709 0 C-N-CA 122.392 2.061 . . . . 0.0 111.868 -179.048 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 20.4 t -85.78 -47.52 9.65 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.432 179.602 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -65.14 -39.07 92.49 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.663 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.765 0 CA-C-O 117.986 -1.452 . . . . 0.0 110.936 -179.951 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.242 0 N-CA-C 109.544 -1.423 . . . . 0.0 109.544 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 88.2 m-70 -59.11 -43.0 91.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.853 0.359 . . . . 0.0 110.598 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 123' ' ' GLY . . . . . . . . . . . . . . . -164.9 117.17 0.74 Allowed Glycine 0 CA--C 1.523 0.57 0 N-CA-C 110.621 -0.992 . . . . 0.0 110.621 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 31.8 m -136.08 161.37 37.86 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 CA-C-O 120.907 0.384 . . . . 0.0 110.33 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 125' ' ' GLU . . . . . 0.491 ' CD ' ' N ' ' B' ' 125' ' ' GLU . 1.0 OUTLIER -130.84 133.38 45.88 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.151 -179.931 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -93.23 45.43 2.43 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 110.634 -0.986 . . . . 0.0 110.634 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 127' ' ' ARG . . . . . . . . . . . . . 78.6 ttt-85 -64.04 133.41 53.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.822 0.344 . . . . 0.0 110.388 -179.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 128' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -79.08 166.47 22.25 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.418 -179.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 129' ' ' ARG . . . . . . . . . . . . . 68.4 mtt180 61.84 62.1 2.45 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.593 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -75.49 44.07 1.17 Allowed 'Trans proline' 0 C--N 1.309 -1.503 0 C-N-CA 122.729 2.286 . . . . 0.0 111.993 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 73.8 m -64.32 146.54 54.24 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.375 179.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 132' ' ' ALA . . . . . . . . . . . . . . . -164.28 71.93 1.65 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.574 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 133' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -68.07 146.73 71.64 Favored 'Trans proline' 0 N--CA 1.491 1.355 0 C-N-CA 122.491 2.128 . . . . 0.0 111.581 -179.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -99.62 23.62 9.28 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.301 -179.626 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -94.38 -62.55 1.31 Allowed 'General case' 0 C--O 1.236 0.359 0 CA-C-O 121.117 0.484 . . . . 0.0 110.81 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 78.3 p -62.38 -37.0 84.06 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.328 179.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -66.2 -47.28 74.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.267 179.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 138' ' ' ALA . . . . . 0.423 ' O ' ' CG2' ' B' ' 142' ' ' VAL . . . -56.33 -39.61 73.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.076 -179.77 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -64.23 -54.09 38.86 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.512 -0.475 . . . . 0.0 110.392 179.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -58.75 -48.03 82.61 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.326 -179.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -61.93 -51.21 69.06 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.22 0.533 . . . . 0.0 111.006 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 142' ' ' VAL . . . . . 0.423 ' CG2' ' O ' ' B' ' 138' ' ' ALA . 96.1 t -61.02 -44.3 97.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.214 -179.699 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -57.5 -41.53 80.95 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 110.062 -0.347 . . . . 0.0 110.062 179.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 68.0 m -59.54 -44.08 93.32 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.199 179.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 71.4 m -62.8 -48.51 78.81 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 120.99 0.424 . . . . 0.0 110.962 179.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 92.7 mt -67.38 -21.59 65.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.528 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 147' ' ' GLN . . . . . . . . . . . . . 56.2 tt0 -75.3 -56.24 4.92 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.634 179.367 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -58.94 -53.96 52.47 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.687 -179.552 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.477 ' O ' ' O ' ' B' ' 150' ' ' ALA . 91.2 mt -47.37 -34.92 7.52 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-O 120.846 0.355 . . . . 0.0 110.179 -179.177 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 150' ' ' ALA . . . . . 0.477 ' O ' ' O ' ' B' ' 149' ' ' LEU . . . -58.74 -140.68 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.54 179.177 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 151' ' ' THR . . . . . 0.428 ' O ' ' O ' ' B' ' 150' ' ' ALA . 29.3 m 57.16 112.04 0.02 OUTLIER Pre-proline 0 CA--C 1.54 0.572 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.951 -179.517 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 152' ' ' PRO . . . . . 0.405 ' O ' ' N ' ' B' ' 155' ' ' LEU . 51.8 Cg_exo -47.47 -58.39 1.76 Allowed 'Trans proline' 0 N--CA 1.5 1.866 0 C-N-CA 122.396 2.064 . . . . 0.0 113.376 -179.068 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 153' ' ' SER . . . . . 0.6 ' HG ' ' H ' ' B' ' 154' ' ' ARG . 88.6 p -45.18 -47.67 12.44 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 121.33 0.585 . . . . 0.0 110.858 -178.761 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 154' ' ' ARG . . . . . 0.6 ' H ' ' HG ' ' B' ' 153' ' ' SER . 83.6 mtp180 -73.52 -25.21 60.32 Favored 'General case' 0 C--N 1.319 -0.729 0 C-N-CA 120.338 -0.545 . . . . 0.0 110.291 179.802 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 155' ' ' LEU . . . . . 0.405 ' N ' ' O ' ' B' ' 152' ' ' PRO . 0.2 OUTLIER -66.42 -55.98 13.18 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 119.855 -0.738 . . . . 0.0 111.283 -178.337 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.66 -45.28 90.86 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.585 179.5 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 97.0 mt -62.59 -45.23 99.32 Favored 'Isoleucine or valine' 0 C--O 1.241 0.653 0 CA-C-O 121.496 0.665 . . . . 0.0 110.406 -179.207 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 5.8 tt -63.21 -41.24 99.12 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.685 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 83.3 m -59.14 -42.84 91.6 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.843 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 17.5 mm100 -57.0 -45.24 83.16 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.966 179.516 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 161' ' ' LEU . . . . . . . . . . . . . 33.2 mt -66.26 -40.68 90.32 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.415 -0.514 . . . . 0.0 111.104 178.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 162' ' ' ARG . . . . . . . . . . . . . 73.7 ttp85 -60.24 -33.07 71.77 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.704 -179.71 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 17.5 t-20 -58.45 -40.52 82.83 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.383 -179.501 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . 168.58 168.92 31.35 Favored Glycine 0 CA--C 1.525 0.673 0 N-CA-C 110.984 -0.846 . . . . 0.0 110.984 179.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -65.83 144.42 77.22 Favored 'Trans proline' 0 C--N 1.308 -1.58 0 C-N-CA 122.836 2.357 . . . . 0.0 111.824 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 2.0 pp -176.23 147.39 0.83 Allowed Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.888 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -72.79 169.14 22.75 Favored 'Trans proline' 0 N--CA 1.496 1.674 0 C-N-CA 122.631 2.221 . . . . 0.0 112.129 179.058 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 168' ' ' VAL . . . . . 0.413 ' CG2' ' N ' ' B' ' 169' ' ' THR . 3.8 m -63.28 -38.27 81.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 121.446 0.641 . . . . 0.0 110.514 -179.69 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 169' ' ' THR . . . . . 0.413 ' N ' ' CG2' ' B' ' 168' ' ' VAL . 71.5 m -58.5 -44.81 89.56 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 114.597 -1.183 . . . . 0.0 110.35 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 53.6 t0 -69.03 -36.46 77.78 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.822 178.661 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 171' ' ' LEU . . . . . 0.424 ' C ' ' CD1' ' B' ' 171' ' ' LEU . 3.1 tm? -63.42 -44.17 95.39 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.001 -0.68 . . . . 0.0 110.308 -179.669 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 172' ' ' ALA . . . . . . . . . . . . . . . -61.0 -43.43 98.9 Favored 'General case' 0 CA--C 1.512 -0.494 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.541 179.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -59.93 -48.19 82.72 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 120.284 -0.566 . . . . 0.0 110.403 179.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -65.04 -52.77 53.99 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.026 -179.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 175' ' ' ILE . . . . . 0.41 ' O ' ' CG2' ' B' ' 175' ' ' ILE . 7.7 tt -176.17 87.42 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.456 -0.131 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.963 -179.425 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . -164.38 -57.41 0.02 OUTLIER Glycine 0 CA--C 1.522 0.491 0 N-CA-C 110.528 -1.029 . . . . 0.0 110.528 178.25 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 65.3 mtt 53.69 27.47 6.91 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.88 -0.328 . . . . 0.0 110.438 179.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 178' ' ' GLU . . . . . 0.431 ' HG2' ' H ' ' B' ' 181' ' ' ALA . 73.8 tt0 -164.62 87.73 0.47 Allowed 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 11.5 mt-30 -73.48 -23.09 60.02 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.822 -179.312 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 78.2 p -66.92 -41.2 87.47 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.86 -179.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 181' ' ' ALA . . . . . 0.431 ' H ' ' HG2' ' B' ' 178' ' ' GLU . . . -66.96 -33.29 75.24 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.27 179.739 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 77.9 t -69.69 -51.27 42.64 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.197 0 C-N-CA 120.721 -0.392 . . . . 0.0 110.781 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 92.1 p -59.28 -41.65 89.42 Favored 'General case' 0 C--N 1.332 -0.154 0 C-N-CA 120.675 -0.41 . . . . 0.0 110.566 -179.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 63.5 t-80 -66.26 -48.49 70.32 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-O 121.114 0.483 . . . . 0.0 110.757 -179.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 2.9 tp-100 -63.81 -37.43 87.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.107 -179.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 9.8 tp -63.22 -44.26 95.78 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.917 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 61.6 ttt85 -59.76 -44.34 93.91 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.614 -0.434 . . . . 0.0 110.23 -179.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 90.1 t -63.38 -54.28 34.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 C-N-CA 120.021 -0.672 . . . . 0.0 110.215 -179.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 85.6 mt -58.96 -36.09 74.23 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.161 0.505 . . . . 0.0 109.989 -179.111 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 70.1 ttt180 -60.21 -41.91 94.05 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.205 179.412 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 39.2 t-20 -60.37 -47.23 86.94 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 120.431 -0.508 . . . . 0.0 110.388 -179.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 192' ' ' LEU . . . . . . . . . . . . . 9.7 mt -65.06 -39.58 93.47 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.918 0.39 . . . . 0.0 110.565 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 193' ' ' GLY . . . . . 0.4 ' O ' ' CD2' ' B' ' 209' ' ' TYR . . . 104.41 28.77 5.63 Favored Glycine 0 CA--C 1.525 0.715 0 N-CA-C 110.855 -0.898 . . . . 0.0 110.855 -179.768 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 92.8 mt -88.86 -19.65 25.62 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.911 0.386 . . . . 0.0 110.758 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 24.6 m -136.05 158.94 39.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.157 -0.474 . . . . 0.0 109.99 179.705 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 196' ' ' VAL . . . . . 0.414 ' CG1' ' N ' ' B' ' 197' ' ' GLY . 41.3 t -141.71 156.29 20.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.442 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 197' ' ' GLY . . . . . 0.414 ' N ' ' CG1' ' B' ' 196' ' ' VAL . . . -117.6 142.23 17.07 Favored Glycine 0 CA--C 1.525 0.703 0 N-CA-C 110.202 -1.159 . . . . 0.0 110.202 179.151 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -114.82 108.3 16.57 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 120.664 0.269 . . . . 0.0 110.364 179.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 61.4 ttp180 -81.48 133.82 35.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.015 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 200' ' ' ALA . . . . . . . . . . . . . . . -145.15 125.13 13.53 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.536 179.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 201' ' ' GLY . . . . . . . . . . . . . . . 50.29 -117.83 5.39 Favored Glycine 0 CA--C 1.526 0.732 0 N-CA-C 110.602 -0.999 . . . . 0.0 110.602 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 202' ' ' ARG . . . . . . . . . . . . . 52.8 ttp180 -111.05 37.79 2.72 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.158 0.504 . . . . 0.0 109.946 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 69.7 m -161.01 150.03 16.59 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.809 -0.441 . . . . 0.0 109.809 179.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -132.23 154.18 39.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.1 179.658 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 26.8 m -127.67 150.05 33.16 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.373 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.548 178.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 65.7 m-85 -106.96 133.74 51.15 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.118 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 58.2 m -151.38 171.79 16.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.274 -179.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . 68.9 mt -64.53 150.2 47.19 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.487 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 209' ' ' TYR . . . . . 0.4 ' CD2' ' O ' ' B' ' 193' ' ' GLY . 5.9 t80 -52.59 -47.44 66.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.394 -179.59 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 89.0 m-20 -140.19 167.4 22.22 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 121.165 0.507 . . . . 0.0 110.603 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 40.9 p -78.17 -23.88 47.48 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.668 179.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 212' ' ' HIS . . . . . 0.551 ' CB ' ' CE1' ' A' ' 104' ' ' HIS . 65.1 m80 -41.4 -59.46 1.56 Allowed 'General case' 0 C--O 1.236 0.373 0 CA-C-O 121.25 0.547 . . . . 0.0 110.552 -179.892 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 8.7 m -55.87 -41.07 65.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.815 -0.63 . . . . 0.0 109.884 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 214' ' ' ALA . . . . . . . . . . . . . . . -55.52 -40.91 72.4 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.471 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 215' ' ' GLN . . . . . 0.439 ' O ' ' OE1' ' B' ' 219' ' ' GLU . 7.1 tp-100 -65.23 -42.78 93.04 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.217 179.733 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 216' ' ' LEU . . . . . . . . . . . . . 12.6 tp -59.25 -46.0 89.67 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.166 -0.614 . . . . 0.0 110.387 -178.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -64.98 -37.09 86.49 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.983 179.282 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 43.6 t0 -58.12 -42.42 85.72 Favored 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 120.496 -0.482 . . . . 0.0 110.49 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 219' ' ' GLU . . . . . 0.494 ' OE1' ' N ' ' B' ' 219' ' ' GLU . 2.4 mp0 -69.34 -51.67 34.74 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.505 179.732 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -58.33 -44.67 88.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.346 -179.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 4.8 mm -62.67 -44.9 99.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.601 -179.265 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 74.5 t80 -64.55 -43.71 93.11 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.069 0.462 . . . . 0.0 110.299 179.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 223' ' ' HIS . . . . . 0.573 ' CE1' ' CB ' ' A' ' 93' ' ' HIS . 32.4 t60 -59.65 -38.96 82.85 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.693 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 9.7 t -77.1 -44.94 28.68 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.991 0.424 . . . . 0.0 111.295 179.593 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -55.93 -31.16 62.67 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.438 -179.229 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -52.47 -70.91 0.08 Allowed 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.373 -0.531 . . . . 0.0 110.118 -179.326 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 227' ' ' LEU . . . . . . . . . . . . . 50.9 mt -109.23 -142.88 0.38 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.966 0.413 . . . . 0.0 109.902 -179.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 228' ' ' HIS . . . . . . . . . . . . . 8.0 p80 -157.97 134.42 9.59 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.582 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 229' ' ' LEU . . . . . 0.51 ' CD2' ' N ' ' B' ' 229' ' ' LEU . 4.0 mm? -63.13 -44.87 94.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.692 -179.793 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . 67.58 -0.64 9.02 Favored Glycine 0 CA--C 1.527 0.788 0 N-CA-C 110.917 -0.873 . . . . 0.0 110.917 179.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 231' ' ' LEU . . . . . 0.408 ' H ' ' C ' ' B' ' 229' ' ' LEU . 80.9 mt -77.48 -110.5 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.777 0.322 . . . . 0.0 110.556 -179.681 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 232' ' ' SER . . . . . . . . . . . . . 37.9 t 55.62 57.47 5.27 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.51 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 233' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -102.73 41.19 1.27 Allowed 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.408 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 234' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -72.65 128.73 36.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.255 179.748 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 235' ' ' HIS . . . . . 0.595 ' N ' ' CD ' ' B' ' 236' ' ' PRO . 0.1 OUTLIER -104.58 -43.03 0.17 Allowed Pre-proline 0 N--CA 1.463 0.222 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.487 179.93 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 236' ' ' PRO . . . . . 0.595 ' CD ' ' N ' ' B' ' 235' ' ' HIS . 31.5 Cg_exo -58.3 136.72 76.4 Favored 'Trans proline' 0 C--N 1.308 -1.604 0 C-N-CA 122.452 2.101 . . . . 0.0 111.876 -179.056 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 237' ' ' SER . . . . . . . . . . . . . 15.7 t -86.18 -48.19 8.79 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.389 179.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 238' ' ' ALA . . . . . . . . . . . . . . . -63.85 -39.57 94.52 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.721 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.752 0 CA-C-O 117.985 -1.453 . . . . 0.0 110.961 179.983 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.234 0 N-CA-C 109.481 -1.447 . . . . 0.0 109.481 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 86.8 m-70 -60.9 -44.49 97.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.864 0.364 . . . . 0.0 110.725 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -89.37 111.94 3.92 Favored Glycine 0 CA--C 1.524 0.608 0 N-CA-C 110.967 -0.853 . . . . 0.0 110.967 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.437 ' C ' ' H ' ' A' ' 7' ' ' GLY . 80.0 t -63.34 -45.15 98.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 120.959 0.409 . . . . 0.0 110.632 -179.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -75.51 41.95 0.2 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.643 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . 0.437 ' H ' ' C ' ' A' ' 5' ' ' VAL . . . -68.88 141.51 36.43 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 110.921 -0.871 . . . . 0.0 110.921 -179.947 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 82.9 mtp180 -78.28 146.83 34.58 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.822 0.344 . . . . 0.0 110.639 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 75.6 m-20 -72.01 141.33 49.33 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.429 179.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.443 ' N ' ' CD ' ' A' ' 11' ' ' PRO . 20.0 ptt180 -156.05 54.58 0.95 Allowed Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.694 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.443 ' CD ' ' N ' ' A' ' 10' ' ' ARG . 46.6 Cg_endo -69.17 164.21 34.82 Favored 'Trans proline' 0 C--N 1.306 -1.68 0 C-N-CA 122.872 2.381 . . . . 0.0 111.893 179.495 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 5.2 m -52.68 134.4 36.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.26 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.401 ' O ' ' NE2' ' A' ' 18' ' ' GLN . . . -170.93 71.81 0.54 Allowed Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.468 -179.751 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -76.58 86.75 1.53 Allowed 'Trans proline' 0 C--N 1.309 -1.552 0 C-N-CA 122.753 2.302 . . . . 0.0 111.979 -179.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 57.0 mt -87.81 -127.74 0.05 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.627 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -99.77 -59.2 1.76 Allowed 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.117 0.485 . . . . 0.0 111.169 179.541 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 58.5 m -53.86 -34.48 59.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.455 -179.22 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.401 ' NE2' ' O ' ' A' ' 13' ' ' ALA . 10.4 tt0 -68.03 -49.57 60.66 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.649 179.932 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -54.74 -35.85 64.17 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.32 -52.66 37.66 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.423 179.26 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.99 -49.2 77.63 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.797 0.332 . . . . 0.0 111.0 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 86.5 mt-30 -56.06 -50.95 69.54 Favored 'General case' 0 C--O 1.242 0.673 0 CA-C-O 121.279 0.561 . . . . 0.0 110.666 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 90.6 t -60.49 -45.09 97.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.784 179.688 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -49.17 -46.17 45.04 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 121.014 -0.274 . . . . 0.0 110.391 179.216 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 36.0 t -59.56 -43.95 93.41 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.101 -0.499 . . . . 0.0 109.85 -179.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 20.2 m -65.68 -51.27 60.78 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.18 0.514 . . . . 0.0 110.812 179.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.415 ' O ' ' O ' ' B' ' 146' ' ' LEU . 4.1 mm? -62.26 -25.58 67.91 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.771 -179.896 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 54.7 tt0 -75.14 -53.38 8.95 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.849 179.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.47 -56.6 19.91 Favored 'General case' 0 CA--C 1.521 -0.171 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.838 -179.232 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.498 ' O ' ' O ' ' A' ' 31' ' ' ALA . 8.0 mp -45.11 -34.91 2.83 Favored 'General case' 0 CA--C 1.516 -0.364 0 C-N-CA 120.958 -0.297 . . . . 0.0 110.214 -179.237 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.498 ' O ' ' O ' ' A' ' 30' ' ' LEU . . . -57.31 -140.48 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.17 0.51 . . . . 0.0 110.357 179.291 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 37.7 m 59.66 110.1 0.02 OUTLIER Pre-proline 0 C--N 1.325 -0.487 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.308 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -51.15 -52.57 8.8 Favored 'Trans proline' 0 N--CA 1.496 1.641 0 C-N-CA 122.372 2.048 . . . . 0.0 113.155 -179.022 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 64.7 m -55.7 -45.48 77.85 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.902 -178.585 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 36.8 ttm180 -61.97 -44.44 96.75 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.733 -179.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 8.3 mt -62.08 -48.45 80.16 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.809 -0.356 . . . . 0.0 110.866 -179.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.468 ' O ' ' OG1' ' A' ' 40' ' ' THR . 49.8 ttp -53.95 -48.84 69.86 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-O 121.233 0.539 . . . . 0.0 110.204 179.612 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 97.9 mt -64.59 -42.72 95.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 121.342 0.591 . . . . 0.0 110.315 179.451 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 12.0 tp -62.24 -42.77 99.62 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.683 -179.273 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.468 ' OG1' ' O ' ' A' ' 37' ' ' MET . 21.3 p -59.52 -38.78 81.88 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.2 -0.455 . . . . 0.0 109.847 179.799 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -60.96 -46.47 90.6 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.536 -0.466 . . . . 0.0 110.005 178.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 92.8 mt -63.57 -38.78 92.45 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.755 179.268 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.42 ' O ' ' ND2' ' A' ' 44' ' ' ASN . 72.5 ttp85 -50.81 -42.82 58.6 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.418 -179.416 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.42 ' ND2' ' O ' ' A' ' 43' ' ' ARG . 12.8 m120 -135.36 48.81 2.22 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.375 179.582 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -175.23 78.77 0.08 OUTLIER Glycine 0 CA--C 1.529 0.959 0 N-CA-C 111.046 -0.822 . . . . 0.0 111.046 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -79.41 112.38 2.98 Favored 'Trans proline' 0 C--N 1.31 -1.461 0 C-N-CA 122.745 2.297 . . . . 0.0 111.504 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -160.75 156.01 21.16 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.622 -178.936 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -66.04 -178.66 1.12 Allowed 'Trans proline' 0 C--N 1.309 -1.527 0 C-N-CA 122.696 2.264 . . . . 0.0 111.89 179.034 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.523 ' CG2' ' N ' ' A' ' 50' ' ' THR . 3.5 m -68.06 -45.7 82.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 121.559 0.695 . . . . 0.0 111.383 -179.836 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.523 ' N ' ' CG2' ' A' ' 49' ' ' VAL . 58.3 p -55.85 -41.22 74.01 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.364 -0.834 . . . . 0.0 110.454 -179.516 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 66.9 m-20 -74.55 -40.24 61.82 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.507 179.457 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.7 tt -60.98 -38.43 85.95 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.825 -179.658 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.585 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -69.63 -45.37 68.65 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.146 179.442 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 81.8 tt0 -52.76 -43.42 65.77 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.767 -0.373 . . . . 0.0 110.089 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -62.33 -42.95 99.8 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.538 179.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 96.6 mt -84.44 -67.12 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.454 179.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . 0.585 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 143.73 70.93 0.02 OUTLIER Glycine 0 CA--C 1.523 0.574 0 N-CA-C 111.141 -0.784 . . . . 0.0 111.141 179.672 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.426 ' C ' ' SD ' ' A' ' 58' ' ' MET . 2.7 tmm? 68.31 97.53 0.06 Allowed 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.76 -0.376 . . . . 0.0 110.762 179.647 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -173.85 24.9 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.078 0.466 . . . . 0.0 110.41 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -70.75 -23.58 62.45 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.044 0.45 . . . . 0.0 110.359 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 9.6 t -66.27 -44.37 83.8 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.584 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.1 -33.22 71.81 Favored 'General case' 0 C--O 1.24 0.605 0 CA-C-N 115.936 -0.575 . . . . 0.0 109.978 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 80.6 t -66.94 -49.99 68.79 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.083 179.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 50.5 m -53.04 -42.55 65.86 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 120.985 0.421 . . . . 0.0 110.163 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 83.4 t60 -58.3 -41.26 84.05 Favored 'General case' 0 C--O 1.242 0.697 0 CA-C-O 121.38 0.61 . . . . 0.0 109.63 178.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 55.1 tt0 -60.45 -38.86 85.51 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.859 -0.61 . . . . 0.0 109.993 179.249 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 24.0 mt -62.19 -42.35 99.2 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.391 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -55.26 -47.19 75.83 Favored 'General case' 0 C--O 1.24 0.575 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.874 179.481 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 90.7 t -68.31 -48.76 71.74 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.153 0 CA-C-O 121.172 0.51 . . . . 0.0 110.403 178.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.658 ' O ' ' N ' ' A' ' 74' ' ' GLY . 0.1 OUTLIER -49.06 -45.54 43.15 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 -179.277 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.612 ' N ' ' HG ' ' A' ' 70' ' ' LEU . 90.5 mtt-85 -62.35 -43.76 98.07 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.791 -178.508 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 99.2 m-20 -65.34 -41.22 94.13 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.598 179.226 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.495 ' CD2' ' N ' ' A' ' 73' ' ' LEU . 4.0 mm? -95.61 -64.32 1.07 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.264 -179.135 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . 0.658 ' N ' ' O ' ' A' ' 70' ' ' LEU . . . 105.97 83.57 1.65 Allowed Glycine 0 CA--C 1.519 0.33 0 N-CA-C 110.54 -1.024 . . . . 0.0 110.54 -179.249 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 14.7 tp -125.64 -14.63 6.24 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.953 0.406 . . . . 0.0 110.549 -179.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.446 ' HA ' ' N ' ' A' ' 90' ' ' TYR . 3.3 m -142.71 172.53 8.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.399 -179.763 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 24.6 t -137.62 150.93 25.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.577 178.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -128.58 146.92 17.26 Favored Glycine 0 CA--C 1.523 0.578 0 N-CA-C 110.446 -1.062 . . . . 0.0 110.446 179.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -120.17 111.27 17.62 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 120.774 0.321 . . . . 0.0 110.435 -179.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 38.5 ptt180 -77.77 151.75 33.9 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.574 179.656 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.455 ' O ' ' N ' ' A' ' 83' ' ' ARG . . . -155.1 94.1 1.6 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.579 179.674 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 57.18 -84.51 0.01 OUTLIER Glycine 0 CA--C 1.524 0.619 0 N-CA-C 110.72 -0.952 . . . . 0.0 110.72 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.455 ' N ' ' O ' ' A' ' 81' ' ' ALA . 35.2 ptt-85 -132.36 31.03 4.11 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 120.71 0.291 . . . . 0.0 110.644 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 41.2 t -146.84 126.13 13.06 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.892 0.377 . . . . 0.0 110.378 -179.787 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 1.4 tp -120.86 129.54 75.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.834 179.576 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 64.8 t -107.09 128.57 61.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.029 178.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 94.3 m-85 -100.23 130.88 46.41 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.672 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 35.2 p -150.56 169.85 20.53 Favored 'General case' 0 C--O 1.223 -0.301 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 179.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.731 ' CD2' ' H ' ' A' ' 89' ' ' LEU . 0.6 OUTLIER -63.74 150.87 43.54 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.661 -179.626 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.446 ' N ' ' HA ' ' A' ' 76' ' ' VAL . 28.4 t80 -51.4 -48.9 62.47 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.244 -178.576 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.531 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 16.0 p-10 -153.05 -178.78 7.15 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.735 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 2.2 m -73.65 -3.26 27.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.422 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 8.5 t-160 -54.01 -74.85 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.062 0.458 . . . . 0.0 110.531 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 11.6 p -57.49 -33.81 45.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.324 -179.521 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.06 -47.67 84.9 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.633 179.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.44 ' O ' ' OE2' ' A' ' 100' ' ' GLU . 59.7 tt0 -63.87 -46.52 84.59 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.393 -179.749 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 13.8 tp -56.74 -45.7 81.83 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.221 -179.325 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 85.7 mt -63.32 -41.0 98.87 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.38 179.204 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -52.16 -45.04 64.91 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.41 -179.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.44 ' OE2' ' O ' ' A' ' 96' ' ' GLN . 0.9 OUTLIER -69.74 -50.46 43.27 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.666 -0.413 . . . . 0.0 110.903 179.782 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -57.92 -53.55 56.91 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.923 -178.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . 0.439 ' N ' ' CD1' ' A' ' 102' ' ' ILE . 1.2 mp -61.74 -44.93 99.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.617 -179.688 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 78.3 t80 -61.23 -50.61 72.39 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 120.492 -0.483 . . . . 0.0 110.804 -179.024 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . 0.41 ' CB ' ' CD2' ' B' ' 212' ' ' HIS . 68.7 m-70 -63.29 -36.96 85.4 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.615 -179.654 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 6.2 t -72.07 -46.14 58.04 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.93 179.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . 0.438 ' C ' ' H ' ' A' ' 108' ' ' LEU . 81.7 tt0 -60.4 -24.43 65.14 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.187 -179.842 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 12.2 t-80 -72.41 6.95 2.02 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.645 179.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.448 ' CG ' ' H ' ' A' ' 109' ' ' HIS . 8.0 tp -136.89 -130.39 0.14 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.719 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . 0.64 ' HD1' ' N ' ' A' ' 110' ' ' LEU . 0.1 OUTLIER -156.68 -4.28 0.11 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.667 -179.778 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.64 ' N ' ' HD1' ' A' ' 109' ' ' HIS . 11.1 mp 40.26 66.03 0.67 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.104 0.478 . . . . 0.0 110.534 -179.78 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -66.27 134.09 33.63 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 110.644 -0.982 . . . . 0.0 110.644 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.446 ' O ' ' OG ' ' A' ' 113' ' ' SER . 0.1 OUTLIER -101.03 14.64 31.32 Favored 'General case' 0 N--CA 1.464 0.271 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 -179.608 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.446 ' OG ' ' O ' ' A' ' 112' ' ' LEU . 86.4 p 52.33 -161.68 0.1 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.487 -179.762 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . 0.521 ' OD1' ' N ' ' A' ' 115' ' ' ARG . 62.0 t0 -132.15 143.34 49.91 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.402 -179.894 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.521 ' N ' ' OD1' ' A' ' 114' ' ' ASP . 33.3 mmt180 -61.79 -157.86 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.404 -179.818 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 24.9 m-70 59.78 71.73 0.86 Allowed Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.504 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_exo -55.39 -31.49 77.72 Favored 'Trans proline' 0 C--N 1.306 -1.668 0 C-N-CA 122.836 2.358 . . . . 0.0 111.943 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 35.5 t -61.59 143.55 55.85 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.549 -179.626 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . 52.14 81.77 0.08 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.566 -179.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.681 0 CA-C-O 118.012 -1.438 . . . . 0.0 110.958 -179.923 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.363 0 N-CA-C 109.494 -1.442 . . . . 0.0 109.494 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 88.1 m-70 -65.55 -41.93 92.45 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.686 0.279 . . . . 0.0 110.549 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 123' ' ' GLY . . . . . . . . . . . . . . . -89.84 111.95 3.95 Favored Glycine 0 CA--C 1.523 0.569 0 N-CA-C 111.0 -0.84 . . . . 0.0 111.0 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 89.3 t -63.51 -44.73 98.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.89 0.376 . . . . 0.0 110.587 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 125' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -77.34 43.95 0.4 Allowed 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.528 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -69.75 141.92 35.73 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 110.914 -0.874 . . . . 0.0 110.914 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 127' ' ' ARG . . . . . . . . . . . . . 83.1 mtp180 -78.41 143.98 36.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.83 0.348 . . . . 0.0 110.627 179.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 128' ' ' ASN . . . . . . . . . . . . . 70.7 m-80 -69.97 141.41 53.01 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.375 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 129' ' ' ARG . . . . . 0.439 ' N ' ' CD ' ' B' ' 130' ' ' PRO . 20.1 ptt180 -156.44 54.81 0.95 Allowed Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.739 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 130' ' ' PRO . . . . . 0.439 ' CD ' ' N ' ' B' ' 129' ' ' ARG . 48.8 Cg_endo -69.41 165.64 29.88 Favored 'Trans proline' 0 C--N 1.307 -1.618 0 C-N-CA 122.923 2.415 . . . . 0.0 111.92 179.533 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 5.9 m -52.95 135.46 36.59 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.32 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 132' ' ' ALA . . . . . 0.524 ' O ' ' NE2' ' B' ' 137' ' ' GLN . . . -172.32 71.57 0.44 Allowed Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.573 -179.724 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 133' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -77.16 86.67 1.59 Allowed 'Trans proline' 0 C--N 1.309 -1.543 0 C-N-CA 122.659 2.24 . . . . 0.0 111.933 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 55.5 mt -88.15 -126.65 0.05 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.453 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -100.21 -60.56 1.5 Allowed 'General case' 0 C--O 1.236 0.365 0 CA-C-O 121.194 0.521 . . . . 0.0 111.179 179.443 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 42.0 m -52.34 -35.76 51.74 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.435 -179.324 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 137' ' ' GLN . . . . . 0.524 ' NE2' ' O ' ' B' ' 132' ' ' ALA . 10.7 tt0 -66.86 -48.93 67.3 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.625 -179.849 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 138' ' ' ALA . . . . . . . . . . . . . . . -55.35 -35.57 65.36 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -67.19 -52.83 36.5 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.946 0.403 . . . . 0.0 110.433 179.33 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -58.13 -48.99 78.53 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.749 179.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 87.1 mt-30 -56.4 -51.09 69.63 Favored 'General case' 0 C--O 1.241 0.608 0 CA-C-O 121.303 0.573 . . . . 0.0 110.779 -179.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 142' ' ' VAL . . . . . . . . . . . . . 93.5 t -60.47 -45.0 97.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.688 179.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -49.84 -46.02 50.91 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.467 179.536 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 14.9 t -58.84 -45.89 88.99 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.207 -0.451 . . . . 0.0 109.933 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 22.9 m -64.61 -51.22 63.8 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 121.121 0.486 . . . . 0.0 110.915 179.244 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 146' ' ' LEU . . . . . 0.415 ' O ' ' O ' ' A' ' 27' ' ' LEU . 4.1 mm? -61.63 -26.7 68.16 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.718 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 147' ' ' GLN . . . . . . . . . . . . . 55.3 tt0 -75.01 -54.31 7.4 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.847 179.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -58.06 -55.9 28.92 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.754 -179.203 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.518 ' O ' ' O ' ' B' ' 150' ' ' ALA . 8.6 mp -45.55 -35.17 3.74 Favored 'General case' 0 CA--C 1.513 -0.479 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.264 -179.228 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 150' ' ' ALA . . . . . 0.518 ' O ' ' O ' ' B' ' 149' ' ' LEU . . . -56.79 -140.7 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.114 0.483 . . . . 0.0 110.434 179.32 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 151' ' ' THR . . . . . . . . . . . . . 84.5 m 59.54 109.38 0.03 OUTLIER Pre-proline 0 C--N 1.324 -0.536 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.336 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -50.46 -54.54 5.28 Favored 'Trans proline' 0 N--CA 1.497 1.689 0 C-N-CA 122.407 2.071 . . . . 0.0 113.066 -179.238 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 52.4 m -53.21 -45.7 68.74 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.953 -178.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 37.7 ttm180 -62.54 -44.28 96.74 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.749 -179.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 155' ' ' LEU . . . . . . . . . . . . . 8.6 mt -62.37 -46.72 87.38 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.831 -0.347 . . . . 0.0 110.918 -179.604 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 156' ' ' MET . . . . . 0.484 ' O ' ' OG1' ' B' ' 159' ' ' THR . 46.6 ttp -55.45 -49.07 73.43 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.298 0.571 . . . . 0.0 110.206 179.623 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 97.0 mt -64.62 -42.84 96.23 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 0 CA-C-O 121.276 0.56 . . . . 0.0 110.258 179.404 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 7.6 tp -62.1 -41.61 98.39 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.7 -179.257 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 159' ' ' THR . . . . . 0.484 ' OG1' ' O ' ' B' ' 156' ' ' MET . 16.9 p -60.67 -38.13 83.88 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.459 . . . . 0.0 109.956 179.85 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 87.1 mt-30 -61.75 -46.27 90.33 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.067 178.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 161' ' ' LEU . . . . . . . . . . . . . 90.4 mt -63.59 -38.72 92.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.713 179.267 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 162' ' ' ARG . . . . . 0.471 ' O ' ' ND2' ' B' ' 163' ' ' ASN . 73.7 ttp85 -50.23 -41.0 49.22 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.505 -179.425 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 163' ' ' ASN . . . . . 0.471 ' ND2' ' O ' ' B' ' 162' ' ' ARG . 16.0 m120 -138.4 49.83 1.9 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.376 179.736 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . -175.87 76.89 0.08 OUTLIER Glycine 0 CA--C 1.528 0.887 0 N-CA-C 111.119 -0.792 . . . . 0.0 111.119 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -77.43 114.34 3.71 Favored 'Trans proline' 0 N--CA 1.494 1.535 0 C-N-CA 122.8 2.333 . . . . 0.0 111.593 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -160.36 157.37 24.32 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.656 -178.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -65.17 176.69 2.99 Favored 'Trans proline' 0 C--N 1.308 -1.595 0 C-N-CA 122.817 2.345 . . . . 0.0 111.753 179.006 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 168' ' ' VAL . . . . . 0.486 ' CG2' ' N ' ' B' ' 169' ' ' THR . 3.8 m -63.22 -43.47 98.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 121.522 0.677 . . . . 0.0 111.306 -179.718 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 169' ' ' THR . . . . . 0.486 ' N ' ' CG2' ' B' ' 168' ' ' VAL . 52.3 p -57.21 -66.65 0.42 Allowed 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.639 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 92.9 m-20 -50.02 -38.69 38.7 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 -179.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 5.0 tt -59.43 -41.91 90.64 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.59 -0.444 . . . . 0.0 109.999 179.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 172' ' ' ALA . . . . . 0.598 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -67.66 -43.19 80.84 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.55 -0.296 . . . . 0.0 110.306 179.386 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 85.3 tt0 -53.33 -42.36 66.65 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.054 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -62.83 -40.87 98.76 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.4 179.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 96.5 mt -87.87 -68.31 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.314 179.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 176' ' ' GLY . . . . . 0.598 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 144.75 72.75 0.02 OUTLIER Glycine 0 CA--C 1.524 0.62 0 N-CA-C 111.078 -0.809 . . . . 0.0 111.078 179.531 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 3.1 tmm? 67.26 97.95 0.05 Allowed 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.673 -0.411 . . . . 0.0 110.591 179.593 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -173.07 22.46 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.204 0.526 . . . . 0.0 110.431 179.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -69.15 -24.75 64.12 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.037 0.446 . . . . 0.0 110.384 -179.876 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 12.1 t -65.71 -43.65 88.47 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 121.182 0.515 . . . . 0.0 110.503 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -60.85 -32.41 71.82 Favored 'General case' 0 C--O 1.239 0.53 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.089 179.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 94.5 t -67.21 -50.56 62.05 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.375 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.102 179.544 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 70.0 m -53.02 -41.94 65.18 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 121.029 0.442 . . . . 0.0 110.129 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -58.59 -42.22 87.58 Favored 'General case' 0 C--O 1.242 0.676 0 CA-C-O 121.406 0.622 . . . . 0.0 109.788 178.634 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 58.4 tt0 -60.09 -38.67 83.63 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.087 179.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 22.1 mt -62.24 -42.71 99.56 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-O 120.922 0.392 . . . . 0.0 110.52 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -54.95 -47.19 74.82 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.681 179.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 97.0 t -67.79 -48.85 74.11 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.106 0 C-N-CA 120.427 -0.509 . . . . 0.0 110.255 178.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 189' ' ' LEU . . . . . 0.686 ' O ' ' N ' ' B' ' 193' ' ' GLY . 0.1 OUTLIER -49.58 -45.4 47.76 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 -179.146 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 190' ' ' ARG . . . . . 0.614 ' N ' ' HG ' ' B' ' 189' ' ' LEU . 90.3 mtt-85 -61.81 -43.21 99.31 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.727 -0.67 . . . . 0.0 109.716 -178.485 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -66.07 -41.07 91.26 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.937 179.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 192' ' ' LEU . . . . . 0.507 ' CD2' ' N ' ' B' ' 192' ' ' LEU . 4.0 mm? -95.8 -61.63 1.42 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.306 -178.862 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 193' ' ' GLY . . . . . 0.686 ' N ' ' O ' ' B' ' 189' ' ' LEU . . . 103.05 82.47 1.63 Allowed Glycine 0 CA--C 1.52 0.349 0 N-CA-C 110.462 -1.055 . . . . 0.0 110.462 -179.42 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 15.6 tp -124.68 -15.0 6.66 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-O 120.951 0.405 . . . . 0.0 110.743 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 195' ' ' VAL . . . . . 0.459 ' HA ' ' N ' ' B' ' 209' ' ' TYR . 3.0 m -142.2 171.91 9.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.376 -179.724 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 196' ' ' VAL . . . . . . . . . . . . . 24.7 t -137.76 152.17 26.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.473 178.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 197' ' ' GLY . . . . . . . . . . . . . . . -130.68 148.36 18.7 Favored Glycine 0 CA--C 1.522 0.494 0 N-CA-C 110.54 -1.024 . . . . 0.0 110.54 179.23 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 89.1 m-20 -120.7 112.87 19.41 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 120.803 0.335 . . . . 0.0 110.621 -179.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 37.1 ptt180 -79.13 150.23 31.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.465 179.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 200' ' ' ALA . . . . . 0.454 ' O ' ' N ' ' B' ' 202' ' ' ARG . . . -153.46 94.29 1.79 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.649 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 201' ' ' GLY . . . . . . . . . . . . . . . 57.91 -83.34 0.01 OUTLIER Glycine 0 CA--C 1.523 0.565 0 N-CA-C 110.793 -0.923 . . . . 0.0 110.793 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 202' ' ' ARG . . . . . 0.454 ' N ' ' O ' ' B' ' 200' ' ' ALA . 36.3 ptt-85 -133.85 28.87 3.85 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 120.664 0.268 . . . . 0.0 110.722 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 38.8 t -143.89 127.1 16.63 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.293 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 1.5 tp -121.29 128.39 75.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.161 -0.472 . . . . 0.0 109.894 179.58 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 71.2 t -105.63 129.52 58.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.071 178.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -101.27 130.76 47.46 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.675 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 18.0 p -151.13 170.3 19.77 Favored 'General case' 0 C--O 1.223 -0.339 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 208' ' ' LEU . . . . . 0.742 ' CD2' ' H ' ' B' ' 208' ' ' LEU . 0.5 OUTLIER -63.41 152.07 39.23 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.653 -179.583 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 209' ' ' TYR . . . . . 0.459 ' N ' ' HA ' ' B' ' 195' ' ' VAL . 29.0 t80 -53.96 -48.38 70.37 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.234 -178.578 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 210' ' ' ASP . . . . . 0.531 ' N ' ' OD1' ' B' ' 210' ' ' ASP . 16.3 p-10 -151.56 179.8 8.06 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.74 179.806 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 2.5 m -74.19 -1.81 22.01 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.473 -179.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 212' ' ' HIS . . . . . 0.41 ' CD2' ' CB ' ' A' ' 104' ' ' HIS . 9.0 t-160 -56.04 -73.63 0.06 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.992 0.425 . . . . 0.0 110.46 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 9.6 p -57.54 -33.02 43.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.319 -179.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 214' ' ' ALA . . . . . . . . . . . . . . . -61.34 -47.96 83.52 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.637 179.699 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 215' ' ' GLN . . . . . 0.443 ' O ' ' OE1' ' B' ' 219' ' ' GLU . 59.4 tt0 -63.69 -46.28 86.23 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.338 -179.698 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 216' ' ' LEU . . . . . . . . . . . . . 14.5 tp -56.58 -46.11 80.98 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.217 -179.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 86.0 mt -63.53 -39.63 94.92 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.281 179.284 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -52.79 -45.44 67.17 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.4 -179.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 219' ' ' GLU . . . . . 0.443 ' OE1' ' O ' ' B' ' 215' ' ' GLN . 1.1 mp0 -70.44 -48.53 55.49 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.98 179.761 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -59.21 -53.4 58.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.046 -179.003 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 221' ' ' ILE . . . . . 0.437 ' N ' ' CD1' ' B' ' 221' ' ' ILE . 1.2 mp -62.27 -44.82 99.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.663 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 75.9 t80 -61.07 -49.9 75.46 Favored 'General case' 0 C--N 1.32 -0.691 0 C-N-CA 120.475 -0.49 . . . . 0.0 110.747 -179.088 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 223' ' ' HIS . . . . . . . . . . . . . 56.4 m-70 -64.06 -37.18 86.49 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.727 -179.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 9.1 t -71.69 -45.99 60.16 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.915 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 225' ' ' GLU . . . . . 0.436 ' C ' ' H ' ' B' ' 227' ' ' LEU . 83.4 tt0 -60.71 -23.63 65.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.369 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 9.8 t-80 -72.47 7.16 1.95 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.615 179.511 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 227' ' ' LEU . . . . . 0.465 ' CG ' ' H ' ' B' ' 228' ' ' HIS . 4.8 tp -138.19 -131.97 0.13 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.697 -179.837 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 228' ' ' HIS . . . . . 0.636 ' HD1' ' N ' ' B' ' 229' ' ' LEU . 0.1 OUTLIER -154.73 -2.7 0.16 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.735 -179.871 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 229' ' ' LEU . . . . . 0.636 ' N ' ' HD1' ' B' ' 228' ' ' HIS . 11.0 mp 39.57 65.73 0.67 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.271 0.558 . . . . 0.0 110.49 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -65.16 134.01 36.64 Favored Glycine 0 CA--C 1.525 0.663 0 N-CA-C 110.663 -0.975 . . . . 0.0 110.663 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 231' ' ' LEU . . . . . 0.424 ' O ' ' OG ' ' B' ' 232' ' ' SER . 0.1 OUTLIER -101.7 14.88 30.65 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 110.131 -0.322 . . . . 0.0 110.131 -179.771 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 232' ' ' SER . . . . . 0.424 ' OG ' ' O ' ' B' ' 231' ' ' LEU . 82.1 p 52.1 -160.98 0.1 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.586 -179.695 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 233' ' ' ASP . . . . . 0.524 ' OD1' ' N ' ' B' ' 234' ' ' ARG . 66.2 t0 -133.64 140.57 47.17 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.458 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 234' ' ' ARG . . . . . 0.524 ' N ' ' OD1' ' B' ' 233' ' ' ASP . 34.2 mmt180 -58.65 -158.9 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.381 -179.807 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 235' ' ' HIS . . . . . . . . . . . . . 25.9 m-70 60.91 71.86 0.77 Allowed Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.62 -179.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 236' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_exo -54.89 -32.93 80.09 Favored 'Trans proline' 0 C--N 1.307 -1.643 0 C-N-CA 122.824 2.349 . . . . 0.0 111.991 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 237' ' ' SER . . . . . . . . . . . . . 47.3 t -60.11 145.76 45.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.43 -179.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 238' ' ' ALA . . . . . . . . . . . . . . . 48.39 81.15 0.05 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.469 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.75 0 CA-C-O 118.022 -1.432 . . . . 0.0 110.907 179.865 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.263 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 80.5 m80 -85.34 125.42 32.93 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.848 0.356 . . . . 0.0 110.442 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -74.55 150.84 42.28 Favored Glycine 0 CA--C 1.523 0.549 0 N-CA-C 110.815 -0.914 . . . . 0.0 110.815 179.857 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 64.8 t -125.02 132.12 71.7 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.383 0 CA-C-O 120.849 0.357 . . . . 0.0 110.172 179.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 82.3 tt0 -90.57 99.03 12.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.038 179.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . 0.45 ' O ' ' O ' ' A' ' 8' ' ' ARG . . . -91.34 2.28 77.93 Favored Glycine 0 CA--C 1.523 0.562 0 N-CA-C 110.941 -0.863 . . . . 0.0 110.941 179.87 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.45 ' O ' ' O ' ' A' ' 7' ' ' GLY . 96.2 mtt-85 50.85 104.64 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.779 0.323 . . . . 0.0 110.439 -179.911 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.439 ' ND2' ' O ' ' A' ' 8' ' ' ARG . 27.7 m120 -147.79 170.51 17.44 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.927 0.394 . . . . 0.0 110.449 -179.822 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 9.1 tpp85 -157.96 63.45 2.72 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.69 -179.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -74.15 160.55 42.38 Favored 'Trans proline' 0 C--N 1.308 -1.6 0 C-N-CA 122.951 2.434 . . . . 0.0 112.263 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 82.5 p -72.55 164.15 26.9 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.253 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.432 ' C ' HE21 ' A' ' 18' ' ' GLN . . . -155.62 62.6 3.28 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.541 -179.84 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -70.19 154.67 65.84 Favored 'Trans proline' 0 C--N 1.31 -1.498 0 C-N-CA 122.891 2.394 . . . . 0.0 111.654 179.795 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.401 ' CD2' ' H ' ' A' ' 15' ' ' LEU . 0.1 OUTLIER -82.12 8.9 9.63 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.177 -179.696 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -96.35 -62.3 1.3 Allowed 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.12 0.486 . . . . 0.0 110.768 179.409 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 46.0 m -59.18 -33.35 70.84 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.228 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.432 HE21 ' C ' ' A' ' 13' ' ' ALA . 75.1 mt-30 -67.56 -49.15 64.57 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.496 179.69 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -57.95 -36.07 72.02 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.927 -0.309 . . . . 0.0 110.289 -179.826 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.71 -53.52 26.9 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 120.884 0.373 . . . . 0.0 110.492 179.637 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.08 -42.07 99.55 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.912 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 16.5 mm100 -61.32 -52.9 62.75 Favored 'General case' 0 C--O 1.239 0.509 0 CA-C-O 121.304 0.573 . . . . 0.0 110.644 -179.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 74.4 t -62.19 -47.09 94.75 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.854 179.589 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -53.13 -42.81 66.4 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 120.809 -0.356 . . . . 0.0 110.252 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 50.0 m -59.55 -43.39 93.56 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.332 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 17.6 m -64.42 -51.98 60.47 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 120.449 -0.5 . . . . 0.0 110.725 179.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.445 ' N ' ' CD1' ' A' ' 27' ' ' LEU . 7.9 mp -66.16 -20.02 66.01 Favored 'General case' 0 CA--C 1.513 -0.457 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.615 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 54.1 tt0 -74.01 -63.44 1.22 Allowed 'General case' 0 C--N 1.32 -0.687 0 O-C-N 123.418 0.449 . . . . 0.0 110.842 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -57.47 -51.96 67.32 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.939 -179.191 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.437 ' O ' ' C ' ' A' ' 31' ' ' ALA . 4.1 mm? -54.52 -39.15 67.35 Favored 'General case' 0 CA--C 1.508 -0.645 0 C-N-CA 120.876 -0.329 . . . . 0.0 110.279 -178.851 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.555 ' O ' ' C ' ' A' ' 32' ' ' THR . . . -37.67 -69.31 0.12 Allowed 'General case' 0 CA--C 1.511 -0.549 0 O-C-N 123.531 0.519 . . . . 0.0 110.062 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.555 ' C ' ' O ' ' A' ' 31' ' ' ALA . 15.9 m -5.57 111.57 0.03 OUTLIER Pre-proline 0 CA--C 1.54 0.595 0 O-C-N 124.851 1.344 . . . . 0.0 111.124 -179.334 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_exo -45.75 -42.9 19.39 Favored 'Trans proline' 0 C--N 1.309 -1.511 0 C-N-CA 122.246 1.964 . . . . 0.0 112.652 -178.008 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 67.5 m -57.66 -46.69 83.9 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.609 -179.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -67.06 -36.85 82.93 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.053 0.454 . . . . 0.0 110.179 179.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.2 -52.85 63.91 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 120.097 -0.641 . . . . 0.0 110.725 -178.047 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 64.2 ttp -62.74 -44.48 96.1 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.938 179.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 89.3 mt -60.26 -44.56 95.89 Favored 'Isoleucine or valine' 0 C--O 1.242 0.678 0 CA-C-O 121.584 0.707 . . . . 0.0 110.685 -178.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -63.84 -39.0 93.18 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.632 179.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 14.9 m -59.02 -39.32 81.57 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.797 179.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -62.31 -44.77 95.73 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.235 179.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.449 ' O ' ' N ' ' A' ' 45' ' ' GLY . 23.6 mt -62.51 -43.12 99.58 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 120.504 -0.478 . . . . 0.0 111.293 179.686 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.489 HH21 ' CG ' ' A' ' 99' ' ' ASP . 79.3 ttt-85 -40.14 -31.12 0.11 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.685 -179.703 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 78.3 m-20 -60.07 -42.3 94.25 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.267 -179.497 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.449 ' N ' ' O ' ' A' ' 42' ' ' LEU . . . 126.29 -116.08 2.46 Favored Glycine 0 CA--C 1.535 1.339 0 N-CA-C 111.384 -0.686 . . . . 0.0 111.384 179.204 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -73.95 128.83 12.7 Favored 'Trans proline' 0 N--CA 1.495 1.609 0 C-N-CA 122.271 1.981 . . . . 0.0 112.434 -179.153 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -176.33 86.46 0.27 Allowed Pre-proline 0 C--N 1.327 -0.407 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.445 179.443 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -49.35 171.12 0.08 OUTLIER 'Trans proline' 0 C--N 1.306 -1.688 0 C-N-CA 122.742 2.294 . . . . 0.0 112.281 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 70.4 t -55.4 -44.28 75.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.25 -179.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 19.0 m -61.75 -44.32 97.12 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.284 179.207 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 66.2 t0 -63.94 -40.35 96.25 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-O 121.383 0.611 . . . . 0.0 110.296 179.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.1 tt -61.31 -44.19 97.62 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.778 -0.646 . . . . 0.0 109.831 -179.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.579 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -59.21 -43.73 92.27 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 179.543 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 84.7 tt0 -54.56 -47.05 73.72 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.068 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -57.89 -49.98 74.87 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.546 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 96.8 mt -85.36 -73.76 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.522 -0.126 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.238 179.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . 0.579 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 131.74 77.37 0.14 Allowed Glycine 0 N--CA 1.461 0.331 0 N-CA-C 111.472 -0.651 . . . . 0.0 111.472 179.218 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.473 ' CB ' ' O ' ' A' ' 57' ' ' GLY . 23.2 ttm 80.93 99.26 0.06 Allowed 'General case' 0 C--O 1.234 0.239 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.955 178.867 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 179.32 22.18 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.165 179.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 55.3 mt-30 -56.92 -27.82 61.34 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 120.825 0.345 . . . . 0.0 111.135 -179.145 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 45.7 m -70.04 -45.83 66.33 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 120.931 0.396 . . . . 0.0 111.212 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.26 -29.3 70.65 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.116 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 70.0 t -72.66 -52.21 24.25 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.246 0 C-N-CA 120.546 -0.461 . . . . 0.0 110.596 179.751 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 11.1 t -55.2 -43.37 74.34 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.303 -0.559 . . . . 0.0 110.558 -179.383 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 60.0 t-80 -69.62 -49.45 53.81 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.364 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 70.1 tp60 -58.98 -45.35 90.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.58 -179.231 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.401 ' O ' ' CG ' ' A' ' 71' ' ' ARG . 3.1 mm? -63.63 -40.11 96.06 Favored 'General case' 0 CA--C 1.502 -0.878 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.479 -179.885 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 72.1 ttt180 -58.24 -43.63 87.89 Favored 'General case' 0 C--N 1.303 -1.414 0 C-N-CA 120.016 -0.673 . . . . 0.0 110.099 179.364 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 91.9 t -67.84 -53.83 27.52 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.385 179.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.599 ' O ' ' N ' ' A' ' 74' ' ' GLY . 94.2 mt -57.93 -38.38 75.83 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-N 116.151 -0.477 . . . . 0.0 109.807 -179.507 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.401 ' CG ' ' O ' ' A' ' 67' ' ' LEU . 11.0 mmm180 -59.93 -43.42 94.95 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.139 179.658 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 88.1 m-20 -64.88 -43.44 92.92 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 120.466 -0.494 . . . . 0.0 110.314 179.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -153.93 73.02 0.92 Allowed 'General case' 0 C--N 1.334 -0.067 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.755 179.28 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . 0.599 ' N ' ' O ' ' A' ' 70' ' ' LEU . . . -147.2 1.05 0.73 Allowed Glycine 0 N--CA 1.464 0.564 0 N-CA-C 110.882 -0.887 . . . . 0.0 110.882 -179.738 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.521 ' CD2' ' N ' ' A' ' 75' ' ' LEU . 3.8 mm? 55.43 61.25 2.95 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.849 0.357 . . . . 0.0 110.994 179.523 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 34.0 m -132.52 156.25 42.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.193 179.217 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.564 ' CG1' ' H ' ' A' ' 78' ' ' GLY . 60.3 t -131.83 174.04 13.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.239 -179.651 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . 0.564 ' H ' ' CG1' ' A' ' 77' ' ' VAL . . . -165.29 159.21 32.32 Favored Glycine 0 CA--C 1.526 0.739 0 N-CA-C 110.519 -1.032 . . . . 0.0 110.519 179.07 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 -115.67 116.52 28.24 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 120.753 0.311 . . . . 0.0 110.697 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 62.3 ttp180 -86.69 137.71 32.24 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.272 179.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.446 ' O ' ' N ' ' A' ' 83' ' ' ARG . . . -148.8 172.85 13.97 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.483 -179.766 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -41.22 94.96 0.01 OUTLIER Glycine 0 CA--C 1.527 0.823 0 N-CA-C 111.023 -0.831 . . . . 0.0 111.023 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.446 ' N ' ' O ' ' A' ' 81' ' ' ALA . 17.5 mmm180 50.13 45.02 25.99 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.886 0.374 . . . . 0.0 110.629 179.888 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 28.5 t -160.23 108.68 1.69 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.548 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 2.2 tp -116.22 129.77 72.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 120.942 0.401 . . . . 0.0 110.064 179.552 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 72.8 t -106.67 131.1 57.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 179.037 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 99.7 m-85 -106.35 130.44 54.18 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.621 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 66.9 m -150.5 171.04 17.7 Favored 'General case' 0 C--N 1.341 0.2 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 49.4 mt -79.24 146.82 32.82 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.56 -179.707 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 6.0 t80 -56.08 -48.06 76.8 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.654 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 75.6 m-20 -125.47 176.39 6.85 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 116.433 -0.348 . . . . 0.0 110.291 -179.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 22.3 p -99.8 -1.84 36.57 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.323 -179.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . 0.572 ' CE1' ' CD2' ' B' ' 223' ' ' HIS . 60.8 m80 -53.61 -55.33 26.77 Favored 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 120.855 -0.338 . . . . 0.0 110.376 -179.817 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 61.4 t -44.5 -39.01 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.047 0.451 . . . . 0.0 110.322 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -71.68 -36.5 70.64 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.939 179.555 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 96.2 mm-40 -64.3 -53.28 51.44 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.188 0.518 . . . . 0.0 111.285 -178.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 3.2 pp -67.94 -39.93 83.39 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.557 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 6.4 tt -65.36 -41.37 93.88 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.226 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . 0.489 ' CG ' HH21 ' A' ' 43' ' ' ARG . 78.4 m-20 -61.86 -38.35 87.93 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.845 -179.646 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.424 ' OE2' ' OE2' ' B' ' 219' ' ' GLU . 97.9 mt-10 -71.67 -44.68 63.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.847 179.308 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -63.06 -49.83 72.99 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.57 -179.637 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 1.2 mp -63.77 -43.83 98.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.875 178.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 89.2 t80 -60.02 -47.82 84.26 Favored 'General case' 0 C--N 1.313 -0.991 0 C-N-CA 120.626 -0.43 . . . . 0.0 110.831 -179.26 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . 0.519 ' CD2' ' CE1' ' B' ' 212' ' ' HIS . 11.7 t-160 -66.65 -35.98 81.47 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.124 179.765 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 4.4 t -73.3 -49.61 26.64 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.002 0.43 . . . . 0.0 111.487 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -67.28 -21.18 65.71 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.626 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 19.8 t60 -51.13 -69.79 0.1 Allowed 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 120.694 -0.403 . . . . 0.0 110.426 -179.277 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 58.4 mt -78.19 -57.95 3.52 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.965 0.412 . . . . 0.0 110.632 -179.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 64.7 t-80 44.37 86.86 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.615 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 93.8 mt -62.9 -42.94 99.96 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.598 -179.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 75.46 5.21 77.12 Favored Glycine 0 N--CA 1.453 -0.17 0 N-CA-C 110.805 -0.918 . . . . 0.0 110.805 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -115.47 115.17 26.06 Favored 'General case' 0 CA--C 1.521 -0.158 0 CA-C-O 120.833 0.349 . . . . 0.0 110.228 -179.831 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.611 ' HG ' HH12 ' A' ' 115' ' ' ARG . 41.3 t -154.33 166.06 34.39 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.506 179.489 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . 0.409 ' OD1' ' O ' ' A' ' 114' ' ' ASP . 47.2 p-10 -90.16 91.0 8.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.651 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.611 HH12 ' HG ' ' A' ' 113' ' ' SER . 80.2 mmt-85 -79.98 148.14 31.29 Favored 'General case' 0 CA--C 1.515 -0.376 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.48 -179.946 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 2.9 p-80 -155.01 151.58 23.38 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.406 179.77 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo -67.02 -70.89 0.02 OUTLIER 'Trans proline' 0 N--CA 1.494 1.501 0 C-N-CA 122.564 2.176 . . . . 0.0 112.252 179.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 30.6 p -80.65 159.65 25.28 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.654 -179.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -69.93 143.76 52.61 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.555 179.849 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.675 0 CA-C-O 117.885 -1.508 . . . . 0.0 110.928 179.992 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.299 0 N-CA-C 109.591 -1.404 . . . . 0.0 109.591 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 80.1 m80 -98.18 126.33 43.59 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.881 0.372 . . . . 0.0 110.283 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 123' ' ' GLY . . . . . . . . . . . . . . . -73.13 149.49 42.65 Favored Glycine 0 CA--C 1.523 0.552 0 N-CA-C 110.693 -0.963 . . . . 0.0 110.693 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 56.7 t -124.33 130.52 73.61 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 CA-C-O 120.88 0.372 . . . . 0.0 110.11 179.764 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 125' ' ' GLU . . . . . . . . . . . . . 79.4 tt0 -88.86 97.91 11.43 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.153 179.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . 0.439 ' O ' ' O ' ' B' ' 127' ' ' ARG . . . -90.62 0.72 77.63 Favored Glycine 0 CA--C 1.523 0.575 0 N-CA-C 110.835 -0.906 . . . . 0.0 110.835 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 127' ' ' ARG . . . . . 0.483 ' O ' ' ND2' ' B' ' 128' ' ' ASN . 96.2 mtt-85 51.97 106.07 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.85 0.357 . . . . 0.0 110.485 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 128' ' ' ASN . . . . . 0.483 ' ND2' ' O ' ' B' ' 127' ' ' ARG . 26.7 m120 -148.69 171.07 16.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.467 -179.787 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 129' ' ' ARG . . . . . . . . . . . . . 9.0 tpp85 -158.73 62.03 2.1 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.664 -179.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -73.32 161.74 42.05 Favored 'Trans proline' 0 C--N 1.307 -1.643 0 C-N-CA 122.891 2.394 . . . . 0.0 112.293 -179.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 10.4 p -73.24 163.53 27.97 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.199 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 132' ' ' ALA . . . . . 0.438 ' C ' HE21 ' B' ' 137' ' ' GLN . . . -154.9 64.36 4.27 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.524 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 133' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -71.94 154.09 58.12 Favored 'Trans proline' 0 C--N 1.312 -1.377 0 C-N-CA 122.879 2.386 . . . . 0.0 111.778 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . 0.432 ' CD2' ' H ' ' B' ' 134' ' ' LEU . 0.1 OUTLIER -81.68 8.73 9.19 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.948 -179.78 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 92.8 m-20 -96.19 -62.25 1.31 Allowed 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.222 0.534 . . . . 0.0 110.722 179.54 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 65.0 m -59.85 -33.04 71.26 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.323 179.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 137' ' ' GLN . . . . . 0.438 HE21 ' C ' ' B' ' 132' ' ' ALA . 75.0 mt-30 -67.88 -49.52 61.55 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.467 179.741 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 138' ' ' ALA . . . . . . . . . . . . . . . -57.49 -35.63 70.45 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.89 -0.324 . . . . 0.0 110.287 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -67.54 -53.35 29.14 Favored 'General case' 0 CA--C 1.528 0.133 0 C-N-CA 120.759 -0.377 . . . . 0.0 110.534 179.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -63.06 -41.31 99.42 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.872 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 19.6 mm100 -62.08 -52.86 62.21 Favored 'General case' 0 C--O 1.239 0.542 0 CA-C-O 121.068 0.461 . . . . 0.0 110.603 -179.571 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 142' ' ' VAL . . . . . . . . . . . . . 84.2 t -62.28 -46.96 95.22 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 179.598 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -53.17 -43.11 66.83 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.193 179.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 69.3 m -59.17 -44.45 92.16 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.426 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 21.6 m -64.52 -51.5 62.6 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.715 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 146' ' ' LEU . . . . . 0.418 ' N ' ' CD1' ' B' ' 146' ' ' LEU . 8.3 mp -66.09 -20.16 66.07 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.681 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 147' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -74.62 -62.93 1.36 Allowed 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.889 179.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -57.91 -52.55 65.01 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.138 -179.12 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.427 ' O ' ' C ' ' B' ' 150' ' ' ALA . 4.2 mm? -53.78 -37.57 63.58 Favored 'General case' 0 CA--C 1.508 -0.665 0 C-N-CA 120.794 -0.362 . . . . 0.0 110.194 -178.884 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 150' ' ' ALA . . . . . 0.552 ' O ' ' C ' ' B' ' 151' ' ' THR . . . -39.31 -70.16 0.11 Allowed 'General case' 0 CA--C 1.511 -0.543 0 O-C-N 123.483 0.49 . . . . 0.0 110.136 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 151' ' ' THR . . . . . 0.552 ' C ' ' O ' ' B' ' 150' ' ' ALA . 11.2 m -5.19 111.43 0.03 OUTLIER Pre-proline 0 N--CA 1.471 0.624 0 O-C-N 124.827 1.329 . . . . 0.0 111.07 -179.301 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -45.55 -42.43 18.46 Favored 'Trans proline' 0 C--N 1.307 -1.634 0 C-N-CA 122.26 1.973 . . . . 0.0 112.686 -177.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 73.0 m -58.02 -45.89 86.18 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.53 -179.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 92.9 mtt180 -68.17 -37.08 80.6 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.191 0.519 . . . . 0.0 110.251 179.55 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 155' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.86 -52.88 63.55 Favored 'General case' 0 C--N 1.32 -0.703 0 C-N-CA 120.032 -0.667 . . . . 0.0 111.009 -178.155 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 65.5 ttp -62.83 -44.13 96.96 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.706 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 80.3 mt -60.38 -44.58 96.34 Favored 'Isoleucine or valine' 0 C--O 1.241 0.636 0 CA-C-O 121.478 0.656 . . . . 0.0 110.465 -179.144 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -63.38 -39.81 95.53 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.662 179.335 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 25.0 m -57.94 -39.89 79.16 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.725 179.594 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 98.9 mm-40 -61.71 -45.1 95.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.236 179.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 161' ' ' LEU . . . . . 0.431 ' O ' ' N ' ' B' ' 164' ' ' GLY . 21.8 mt -62.8 -43.13 99.62 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 120.442 -0.503 . . . . 0.0 111.256 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 162' ' ' ARG . . . . . 0.487 HH21 ' CG ' ' B' ' 218' ' ' ASP . 78.9 ttt-85 -40.46 -30.15 0.1 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.736 -179.834 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 82.3 m-20 -60.48 -42.66 96.71 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.293 -179.333 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 164' ' ' GLY . . . . . 0.431 ' N ' ' O ' ' B' ' 161' ' ' LEU . . . 127.57 -114.89 2.0 Favored Glycine 0 CA--C 1.538 1.469 0 N-CA-C 111.191 -0.764 . . . . 0.0 111.191 179.252 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -75.8 129.09 11.34 Favored 'Trans proline' 0 N--CA 1.494 1.552 0 C-N-CA 122.4 2.067 . . . . 0.0 112.331 -179.537 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -175.91 84.14 0.29 Allowed Pre-proline 0 C--N 1.327 -0.394 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.242 179.457 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 55.1 Cg_exo -48.1 171.79 0.05 OUTLIER 'Trans proline' 0 C--N 1.305 -1.72 0 C-N-CA 122.756 2.304 . . . . 0.0 112.3 -179.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . 72.3 t -55.26 -44.96 77.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.317 -179.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 169' ' ' THR . . . . . . . . . . . . . 13.2 m -62.36 -44.46 96.42 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.367 179.18 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 64.3 t0 -63.3 -39.92 95.9 Favored 'General case' 0 C--O 1.24 0.553 0 CA-C-O 121.433 0.635 . . . . 0.0 110.162 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 4.5 tt -62.12 -43.91 97.81 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.81 -179.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 172' ' ' ALA . . . . . 0.577 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -59.42 -43.94 92.98 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 179.717 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 82.2 tt0 -54.46 -46.78 73.38 Favored 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 120.615 -0.434 . . . . 0.0 109.996 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -58.7 -50.76 72.7 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 120.683 -0.407 . . . . 0.0 110.693 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 93.8 mt -83.97 -73.53 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.102 179.617 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 176' ' ' GLY . . . . . 0.577 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 131.34 77.9 0.16 Allowed Glycine 0 C--N 1.332 0.309 0 N-CA-C 111.567 -0.613 . . . . 0.0 111.567 179.429 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 177' ' ' MET . . . . . 0.456 ' CB ' ' O ' ' B' ' 176' ' ' GLY . 23.9 ttm 79.94 99.39 0.06 Allowed 'General case' 0 C--O 1.233 0.229 0 C-N-CA 120.801 -0.36 . . . . 0.0 111.01 178.793 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 178' ' ' GLU . . . . . 0.424 ' OE1' ' O ' ' B' ' 177' ' ' MET . 1.3 tp10 179.45 22.97 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.18 179.632 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 51.2 mt-30 -57.82 -27.12 62.88 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 120.897 0.38 . . . . 0.0 111.027 -179.124 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 69.6 m -70.41 -45.99 64.84 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.159 179.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -63.47 -29.28 70.59 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.119 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 84.4 t -72.51 -52.41 23.67 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.305 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.45 179.669 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 9.5 t -55.12 -43.13 73.8 Favored 'General case' 0 C--N 1.32 -0.701 0 C-N-CA 120.282 -0.567 . . . . 0.0 110.614 -179.52 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 -69.98 -49.63 49.78 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.329 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 68.4 tp60 -59.02 -45.34 90.96 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.016 0.436 . . . . 0.0 110.652 -179.195 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -63.57 -40.36 96.77 Favored 'General case' 0 CA--C 1.502 -0.893 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.32 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 72.9 ttt180 -58.43 -43.75 88.86 Favored 'General case' 0 C--N 1.304 -1.394 0 C-N-CA 120.08 -0.648 . . . . 0.0 110.242 179.41 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 84.0 t -67.49 -53.5 31.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.169 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.102 179.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 189' ' ' LEU . . . . . 0.589 ' O ' ' N ' ' B' ' 193' ' ' GLY . 94.6 mt -57.73 -38.45 75.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.27 0.557 . . . . 0.0 109.741 -179.513 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 8.9 mmm180 -59.72 -44.13 93.87 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.302 179.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 87.8 m-20 -64.42 -42.86 95.81 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.424 -0.51 . . . . 0.0 110.261 179.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 192' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -154.78 74.56 0.94 Allowed 'General case' 0 C--O 1.23 0.065 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.692 179.292 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 193' ' ' GLY . . . . . 0.589 ' N ' ' O ' ' B' ' 189' ' ' LEU . . . -148.38 0.73 0.59 Allowed Glycine 0 N--CA 1.463 0.471 0 N-CA-C 110.921 -0.872 . . . . 0.0 110.921 -179.648 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 194' ' ' LEU . . . . . 0.535 ' CD2' ' N ' ' B' ' 194' ' ' LEU . 3.7 mm? 56.28 60.44 3.16 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.814 0.34 . . . . 0.0 110.869 179.585 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 34.4 m -131.82 154.72 40.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.205 179.232 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 196' ' ' VAL . . . . . 0.435 ' CG2' ' CD2' ' B' ' 209' ' ' TYR . 54.0 t -136.61 155.9 34.61 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.28 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.541 -179.379 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 197' ' ' GLY . . . . . . . . . . . . . . . -145.67 158.74 27.76 Favored Glycine 0 CA--C 1.521 0.426 0 N-CA-C 110.341 -1.103 . . . . 0.0 110.341 179.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -113.7 114.33 26.23 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 120.941 0.4 . . . . 0.0 110.677 -179.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 62.4 ttp180 -86.37 134.12 33.74 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.28 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 200' ' ' ALA . . . . . . . . . . . . . . . -150.17 112.74 4.72 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.456 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 201' ' ' GLY . . . . . . . . . . . . . . . 47.57 -112.7 1.09 Allowed Glycine 0 CA--C 1.524 0.653 0 N-CA-C 110.46 -1.056 . . . . 0.0 110.46 -179.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 202' ' ' ARG . . . . . . . . . . . . . 20.2 mmm180 -110.13 42.59 1.51 Allowed 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 120.775 0.321 . . . . 0.0 110.415 179.668 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 41.5 t -153.15 122.53 6.69 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.566 179.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 1.4 tp -122.84 127.29 74.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 179.399 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 83.2 t -100.5 129.63 51.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.901 179.018 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 98.9 m-85 -105.45 130.66 53.48 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.557 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 69.9 m -150.82 171.52 17.09 Favored 'General case' 0 C--O 1.227 -0.12 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . 41.1 mt -79.04 147.44 32.84 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.535 -179.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 209' ' ' TYR . . . . . 0.435 ' CD2' ' CG2' ' B' ' 196' ' ' VAL . 5.9 t80 -55.66 -48.48 74.96 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.715 -0.394 . . . . 0.0 110.348 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 80.4 m-20 -124.74 -178.54 4.18 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 -179.716 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 66.6 p -104.02 -2.68 25.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.362 -179.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 212' ' ' HIS . . . . . 0.519 ' CE1' ' CD2' ' A' ' 104' ' ' HIS . 65.5 m80 -52.62 -54.98 25.73 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.332 -179.769 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 10.6 t -44.67 -40.01 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 121.039 0.447 . . . . 0.0 110.282 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 214' ' ' ALA . . . . . . . . . . . . . . . -71.61 -36.75 70.89 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.906 179.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 97.5 mm-40 -64.24 -53.76 43.99 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.227 0.537 . . . . 0.0 111.223 -178.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 216' ' ' LEU . . . . . . . . . . . . . 3.1 pp -67.29 -40.08 86.07 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.621 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 6.3 tt -65.05 -42.33 94.35 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.467 -179.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 218' ' ' ASP . . . . . 0.487 ' CG ' HH21 ' B' ' 162' ' ' ARG . 93.5 m-20 -61.13 -37.9 84.47 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.027 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 219' ' ' GLU . . . . . 0.424 ' OE2' ' OE2' ' A' ' 100' ' ' GLU . 97.2 mt-10 -71.79 -42.59 66.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.854 179.194 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -65.71 -49.37 68.73 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.006 0.432 . . . . 0.0 110.642 -179.747 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 1.3 mp -63.99 -43.02 97.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.331 179.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 89.1 t80 -60.37 -48.12 83.1 Favored 'General case' 0 C--N 1.314 -0.952 0 C-N-CA 120.609 -0.437 . . . . 0.0 110.939 -179.28 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 223' ' ' HIS . . . . . 0.572 ' CD2' ' CE1' ' A' ' 93' ' ' HIS . 12.0 t-160 -67.07 -35.15 79.19 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.15 179.759 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 23.3 t -74.18 -50.29 19.9 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.952 0.406 . . . . 0.0 111.336 -179.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 71.9 mm-40 -66.73 -22.01 66.06 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.673 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 10.5 t60 -50.92 -69.49 0.11 Allowed 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 120.664 -0.415 . . . . 0.0 110.487 -179.221 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 227' ' ' LEU . . . . . . . . . . . . . 72.4 mt -76.78 -57.62 3.75 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.759 -179.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 228' ' ' HIS . . . . . . . . . . . . . 63.7 t-80 43.11 86.37 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.803 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 229' ' ' LEU . . . . . . . . . . . . . 95.1 mt -63.02 -42.82 99.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.477 -179.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . 76.43 3.72 78.25 Favored Glycine 0 N--CA 1.453 -0.176 0 N-CA-C 110.826 -0.909 . . . . 0.0 110.826 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 231' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -113.61 117.45 31.64 Favored 'General case' 0 N--CA 1.461 0.098 0 CA-C-O 120.807 0.336 . . . . 0.0 110.239 -179.727 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 232' ' ' SER . . . . . 0.638 ' HG ' HH12 ' B' ' 234' ' ' ARG . 48.5 t -155.83 165.57 36.09 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.473 179.412 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 233' ' ' ASP . . . . . 0.434 ' O ' ' OD1' ' B' ' 233' ' ' ASP . 49.6 p-10 -90.36 89.01 7.42 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.635 179.9 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 234' ' ' ARG . . . . . 0.638 HH12 ' HG ' ' B' ' 232' ' ' SER . 79.8 mmt-85 -78.29 148.4 33.87 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.545 -179.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 235' ' ' HIS . . . . . . . . . . . . . 2.4 p-80 -155.25 152.42 24.9 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.592 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 236' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -67.03 -72.42 0.02 OUTLIER 'Trans proline' 0 N--CA 1.495 1.569 0 C-N-CA 122.598 2.198 . . . . 0.0 112.021 179.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 237' ' ' SER . . . . . . . . . . . . . 25.8 p -79.68 160.19 26.4 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.64 -179.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 238' ' ' ALA . . . . . . . . . . . . . . . -71.58 142.7 50.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.559 179.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.772 0 CA-C-O 118.031 -1.427 . . . . 0.0 110.972 179.964 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.289 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 79.2 m80 -79.61 135.87 36.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.73 0.3 . . . . 0.0 110.541 -179.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . 0.591 ' C ' ' H ' ' A' ' 6' ' ' GLU . . . 164.0 -105.19 0.25 Allowed Glycine 0 CA--C 1.517 0.219 0 N-CA-C 110.966 -0.854 . . . . 0.0 110.966 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER 69.99 -22.86 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 CA-C-O 120.781 0.324 . . . . 0.0 110.524 -179.593 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.591 ' H ' ' C ' ' A' ' 4' ' ' GLY . 97.9 mt-10 -75.46 155.48 36.21 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.764 -177.17 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 88.68 53.63 2.54 Favored Glycine 0 CA--C 1.525 0.667 0 N-CA-C 111.044 -0.822 . . . . 0.0 111.044 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 90.6 mtm-85 -63.19 -41.84 99.26 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.691 0.282 . . . . 0.0 110.532 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.433 ' O ' ' O ' ' A' ' 10' ' ' ARG . 51.5 p30 -115.86 31.59 6.62 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.552 179.823 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.433 ' O ' ' O ' ' A' ' 9' ' ' ASN . 27.5 mmt180 59.15 147.58 0.07 OUTLIER Pre-proline 0 N--CA 1.448 -0.56 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.89 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_exo -45.65 133.16 13.35 Favored 'Trans proline' 0 C--N 1.309 -1.534 0 C-N-CA 122.398 2.065 . . . . 0.0 112.248 179.642 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 98.9 p -96.87 0.0 48.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.59 179.747 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -166.64 149.34 6.09 Favored Pre-proline 0 C--N 1.324 -0.506 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.868 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -68.58 88.56 0.42 Allowed 'Trans proline' 0 C--N 1.309 -1.541 0 C-N-CA 122.569 2.179 . . . . 0.0 112.077 179.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 55.1 mt -62.79 -173.51 0.05 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.513 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 30.8 m-20 -95.19 -31.09 13.68 Favored 'General case' 0 C--O 1.245 0.82 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.678 179.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 10.2 t -53.64 -57.71 9.79 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.387 -178.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 17.2 mp0 -44.98 -47.46 11.46 Favored 'General case' 0 C--O 1.21 -0.992 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 179.291 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -50.58 -56.45 11.65 Favored 'General case' 0 C--O 1.242 0.664 0 C-N-CA 120.425 -0.51 . . . . 0.0 110.008 -178.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.17 -53.5 48.34 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.756 179.453 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -51.3 -47.64 62.53 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.778 -179.439 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 70.8 tp60 -54.48 -51.98 63.35 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-O 120.921 0.391 . . . . 0.0 110.274 -179.266 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 88.8 t -64.34 -47.53 89.22 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.53 179.779 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.04 -44.87 83.35 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.092 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 11.3 t -56.05 -42.78 77.13 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 26.3 m -60.11 -50.33 74.14 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.476 179.424 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.467 ' N ' ' CD1' ' A' ' 27' ' ' LEU . 7.2 mp -68.06 -23.21 64.93 Favored 'General case' 0 CA--C 1.522 -0.128 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.572 179.214 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 52.7 tt0 -70.89 -66.81 0.56 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.321 -179.707 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.62 -53.54 57.18 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.882 0.372 . . . . 0.0 110.438 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.503 ' O ' ' O ' ' A' ' 31' ' ' ALA . 46.3 tp -45.2 -28.41 0.77 Allowed 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.631 -179.5 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.503 ' O ' ' O ' ' A' ' 30' ' ' LEU . . . -56.22 -124.4 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.29 179.387 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.464 ' O ' ' O ' ' A' ' 31' ' ' ALA . 85.5 m 55.77 111.26 0.02 OUTLIER Pre-proline 0 C--N 1.324 -0.516 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.319 179.263 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -48.42 -47.99 18.51 Favored 'Trans proline' 0 C--N 1.305 -1.715 0 C-N-CA 122.496 2.131 . . . . 0.0 112.605 -178.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 65.1 m -62.09 -46.62 88.29 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.174 -179.058 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 53.1 ttm-85 -61.21 -45.25 95.36 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.699 -178.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 1.4 tt -59.97 -52.78 63.94 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.666 -0.414 . . . . 0.0 110.343 -178.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 11.3 tpt -51.24 -47.79 62.29 Favored 'General case' 0 C--O 1.238 0.475 0 C-N-CA 120.63 -0.428 . . . . 0.0 110.035 -179.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.425 HG22 HD11 ' A' ' 38' ' ' ILE . 35.4 mm -63.34 -43.09 98.43 Favored 'Isoleucine or valine' 0 C--O 1.246 0.883 0 CA-C-O 121.101 0.477 . . . . 0.0 110.652 179.461 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.46 -43.7 98.19 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.758 -179.422 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 19.3 m -58.29 -40.46 82.0 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.913 179.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 60.7 tp60 -58.0 -45.55 86.67 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.113 179.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 11.4 mt -65.42 -39.21 91.86 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.255 178.105 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 3.4 tmt_? -53.64 -46.07 70.4 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.583 -178.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 29.2 t-20 -61.44 -38.79 88.45 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.994 0.426 . . . . 0.0 110.226 179.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -173.55 157.11 25.4 Favored Glycine 0 CA--C 1.527 0.8 0 N-CA-C 111.074 -0.811 . . . . 0.0 111.074 179.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.446 ' O ' ' O ' ' A' ' 47' ' ' LEU . 51.9 Cg_endo -71.34 -74.58 0.01 OUTLIER 'Trans proline' 0 C--N 1.31 -1.49 0 C-N-CA 122.727 2.285 . . . . 0.0 112.697 179.769 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.446 ' O ' ' O ' ' A' ' 46' ' ' PRO . 0.5 OUTLIER 59.57 144.59 0.05 OUTLIER Pre-proline 0 C--N 1.321 -0.643 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.022 178.306 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -67.54 167.28 21.25 Favored 'Trans proline' 0 C--N 1.305 -1.712 0 C-N-CA 122.554 2.169 . . . . 0.0 111.877 178.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.467 ' O ' ' OE1' ' A' ' 60' ' ' GLN . 66.9 t -58.69 -41.77 83.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.131 -179.925 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -60.28 -41.5 93.47 Favored 'General case' 0 C--O 1.248 0.991 0 CA-C-O 121.471 0.653 . . . . 0.0 110.69 179.78 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -64.96 -38.66 91.69 Favored 'General case' 0 C--O 1.239 0.551 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.04 179.664 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 17.9 mt -62.44 -35.23 78.63 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.342 179.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.495 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -60.96 -46.33 91.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.785 178.678 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 70.3 mm-40 -57.61 -47.95 80.75 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 120.484 -0.487 . . . . 0.0 110.28 179.751 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.14 -44.58 88.16 Favored 'General case' 0 C--O 1.232 0.166 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.447 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 97.4 mt -97.62 -80.05 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.461 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . 0.495 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 156.94 103.19 0.2 Allowed Glycine 0 CA--C 1.526 0.723 0 N-CA-C 110.767 -0.933 . . . . 0.0 110.767 -179.624 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.517 ' O ' ' NE2' ' A' ' 60' ' ' GLN . 70.2 mmm 43.3 -114.84 0.34 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.109 0.481 . . . . 0.0 110.471 179.723 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 50.33 13.17 0.11 Allowed 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.417 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.517 ' NE2' ' O ' ' A' ' 58' ' ' MET . 3.2 mm-40 -50.85 -29.59 12.21 Favored 'General case' 0 C--O 1.238 0.498 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.667 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 3.0 t -72.98 -33.88 66.11 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.298 179.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.5 -38.96 74.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.123 -178.583 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 12.5 m -71.06 -47.02 63.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.568 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 11.0 t -58.16 -43.96 87.67 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 -179.7 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -64.61 -51.05 64.72 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.845 179.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -61.72 -39.84 92.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.6 179.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.3 tp -60.91 -43.56 98.38 Favored 'General case' 0 C--O 1.218 -0.596 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.038 -179.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 72.3 ttt180 -60.73 -42.23 96.89 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-O 120.829 0.347 . . . . 0.0 110.316 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 85.7 t -59.97 -54.75 30.42 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 C-N-CA 120.446 -0.502 . . . . 0.0 110.132 -179.201 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.423 ' CD2' ' N ' ' A' ' 70' ' ' LEU . 4.3 mm? -64.12 -37.83 88.86 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.584 179.079 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 60.1 ttt85 -52.25 -41.7 63.04 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.121 -179.477 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 -56.86 -45.75 82.27 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 120.587 -0.445 . . . . 0.0 110.293 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.0 mt -67.83 -39.06 83.93 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 110.021 -0.363 . . . . 0.0 110.021 179.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 96.74 46.47 2.48 Favored Glycine 0 CA--C 1.52 0.364 0 N-CA-C 110.989 -0.845 . . . . 0.0 110.989 -179.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 5.0 tp -105.78 -9.21 17.36 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.91 0.386 . . . . 0.0 110.763 -179.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.9 m -135.65 160.22 39.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.508 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -153.59 174.63 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.91 -179.703 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -143.85 156.48 26.68 Favored Glycine 0 C--N 1.332 0.34 0 N-CA-C 110.825 -0.91 . . . . 0.0 110.825 179.169 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -123.89 137.13 54.69 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 120.768 0.318 . . . . 0.0 110.4 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 63.8 ttm-85 -89.25 135.28 33.66 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.509 179.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -151.56 133.84 15.27 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.62 179.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 47.45 -112.35 0.99 Allowed Glycine 0 CA--C 1.519 0.343 0 N-CA-C 110.862 -0.895 . . . . 0.0 110.862 179.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 84.9 mtp180 -119.56 29.73 7.45 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 120.678 0.275 . . . . 0.0 110.494 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 73.6 m -154.86 174.21 15.42 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 121.033 0.444 . . . . 0.0 110.296 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 1.2 pp -136.65 161.7 36.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.475 179.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 3.3 m -122.86 128.51 75.24 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.767 178.747 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 71.7 m-85 -89.96 119.07 30.01 Favored 'General case' 0 C--O 1.22 -0.495 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.054 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 66.6 m -133.04 152.59 51.95 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-O 120.966 0.412 . . . . 0.0 110.385 -179.321 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.703 ' CD2' ' H ' ' A' ' 89' ' ' LEU . 0.5 OUTLIER -73.03 137.6 45.45 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.526 179.927 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 66.3 t80 -61.71 -50.31 72.94 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.736 -179.644 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 39.6 t0 -89.75 130.49 36.01 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.793 -179.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 11.8 m -93.45 -28.98 15.8 Favored 'General case' 0 C--O 1.244 0.777 0 CA-C-O 121.309 0.576 . . . . 0.0 110.389 179.345 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . 0.579 ' CG ' ' CD2' ' B' ' 223' ' ' HIS . 75.9 m80 -55.21 -46.06 75.9 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.122 179.817 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.448 ' CG1' ' N ' ' A' ' 95' ' ' ALA . 13.1 p -53.05 -44.21 50.27 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.203 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . 0.448 ' N ' ' CG1' ' A' ' 94' ' ' VAL . . . -57.08 -37.2 71.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.065 179.124 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -64.06 -38.93 92.87 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-O 121.23 0.538 . . . . 0.0 110.175 179.304 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 50.2 mt -61.21 -44.55 97.1 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.248 179.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.407 ' N ' ' CD2' ' A' ' 98' ' ' LEU . 4.2 mm? -66.94 -37.06 83.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.832 178.52 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -57.51 -47.26 82.43 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.189 -179.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.457 ' OE2' ' OE2' ' B' ' 219' ' ' GLU . 97.7 mt-10 -69.87 -52.31 25.84 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.548 179.238 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -53.3 -46.82 69.53 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.519 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 4.8 mm -62.52 -44.53 99.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.352 -179.377 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' TYR . . . . . 0.633 ' CE1' ' NE2' ' A' ' 107' ' ' HIS . 85.1 t80 -60.84 -46.89 88.78 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.989 0.423 . . . . 0.0 110.421 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . 0.55 ' CD2' ' CG ' ' B' ' 212' ' ' HIS . 18.3 t-80 -57.0 -39.73 75.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.614 -179.82 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 36.1 t -76.28 -40.35 51.96 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.161 179.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -56.78 -33.96 67.15 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.408 -179.213 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . 0.633 ' NE2' ' CE1' ' A' ' 103' ' ' TYR . 9.2 m-70 -80.62 -2.21 45.54 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.513 179.66 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -144.35 103.82 4.02 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.446 179.704 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . 0.46 ' ND1' ' C ' ' A' ' 109' ' ' HIS . 7.2 p80 -158.65 5.01 0.11 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.647 179.531 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.406 ' CD1' ' N ' ' A' ' 110' ' ' LEU . 10.8 mp -63.02 -42.2 99.75 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.418 -179.355 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -75.24 -59.67 3.54 Favored Glycine 0 CA--C 1.52 0.366 0 N-CA-C 110.9 -0.88 . . . . 0.0 110.9 -179.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 10.6 tp 38.53 75.45 0.07 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.81 0.338 . . . . 0.0 110.748 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 40.7 t -106.0 124.22 49.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.38 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -94.7 113.99 25.86 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.534 -179.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.492 ' O ' ' CG ' ' A' ' 116' ' ' HIS . 30.2 mmt180 -82.06 92.52 6.83 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.388 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . 0.492 ' CG ' ' O ' ' A' ' 115' ' ' ARG . 53.6 m-70 -160.11 56.22 0.81 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.45 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . 0.41 ' CD ' ' N ' ' A' ' 116' ' ' HIS . 49.0 Cg_endo -69.16 154.79 69.57 Favored 'Trans proline' 0 C--N 1.307 -1.643 0 C-N-CA 122.696 2.264 . . . . 0.0 112.154 179.871 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 35.5 p -156.76 163.12 39.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.54 179.589 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . 56.99 46.49 19.32 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.71 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.678 0 CA-C-O 117.983 -1.454 . . . . 0.0 110.943 -179.978 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.337 0 N-CA-C 109.532 -1.427 . . . . 0.0 109.532 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 80.4 m80 -79.42 139.27 37.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.854 0.359 . . . . 0.0 110.38 179.819 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 123' ' ' GLY . . . . . 0.588 ' C ' ' H ' ' B' ' 125' ' ' GLU . . . 161.24 -108.95 0.37 Allowed Glycine 0 C--O 1.227 -0.339 0 N-CA-C 110.959 -0.857 . . . . 0.0 110.959 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER 71.15 -21.76 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.231 0.129 0 CA-C-O 120.789 0.328 . . . . 0.0 110.551 -179.63 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 125' ' ' GLU . . . . . 0.588 ' H ' ' C ' ' B' ' 123' ' ' GLY . 96.5 mt-10 -77.05 157.11 31.31 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.717 -177.264 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 85.32 53.69 3.04 Favored Glycine 0 CA--C 1.524 0.608 0 N-CA-C 110.992 -0.843 . . . . 0.0 110.992 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 127' ' ' ARG . . . . . . . . . . . . . 89.5 mtm-85 -62.63 -41.63 99.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.68 0.276 . . . . 0.0 110.524 -179.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 128' ' ' ASN . . . . . 0.443 ' O ' ' O ' ' B' ' 129' ' ' ARG . 52.8 p-10 -115.01 32.42 6.05 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.594 179.923 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 129' ' ' ARG . . . . . 0.443 ' O ' ' O ' ' B' ' 128' ' ' ASN . 26.7 mmt180 58.98 148.01 0.07 OUTLIER Pre-proline 0 N--CA 1.447 -0.579 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.909 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -47.16 133.98 19.04 Favored 'Trans proline' 0 C--N 1.309 -1.538 0 C-N-CA 122.416 2.077 . . . . 0.0 112.229 179.537 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 87.7 p -96.92 0.93 49.8 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.703 179.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 132' ' ' ALA . . . . . . . . . . . . . . . -167.02 148.86 5.48 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.966 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 133' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -68.4 85.17 0.45 Allowed 'Trans proline' 0 C--N 1.309 -1.503 0 C-N-CA 122.57 2.18 . . . . 0.0 112.016 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 47.7 mt -58.82 -173.53 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.433 179.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -95.92 -30.38 13.66 Favored 'General case' 0 C--O 1.247 0.927 0 CA-C-O 121.196 0.522 . . . . 0.0 110.725 179.768 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 10.0 t -54.07 -57.18 12.05 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.379 -178.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 14.0 mp0 -46.01 -47.27 16.82 Favored 'General case' 0 C--O 1.209 -1.038 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 179.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 138' ' ' ALA . . . . . . . . . . . . . . . -50.04 -56.25 11.55 Favored 'General case' 0 C--O 1.242 0.706 0 C-N-CA 120.423 -0.511 . . . . 0.0 109.998 -178.348 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -64.5 -53.15 52.65 Favored 'General case' 0 N--CA 1.457 -0.108 0 C-N-CA 120.381 -0.528 . . . . 0.0 110.784 179.387 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -51.44 -46.13 62.9 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.875 -179.266 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 68.9 tp60 -55.75 -52.86 62.49 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 120.862 0.363 . . . . 0.0 110.171 -179.291 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 142' ' ' VAL . . . . . . . . . . . . . 90.4 t -63.51 -46.84 94.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.451 179.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -57.55 -45.75 84.74 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.394 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 11.3 t -56.07 -41.72 75.55 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 19.3 m -60.64 -49.05 79.06 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.358 179.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 146' ' ' LEU . . . . . 0.467 ' N ' ' CD1' ' B' ' 146' ' ' LEU . 7.3 mp -69.44 -22.33 63.67 Favored 'General case' 0 CA--C 1.522 -0.122 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.572 179.172 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 147' ' ' GLN . . . . . . . . . . . . . 54.4 tt0 -71.58 -66.04 0.68 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.195 -179.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -59.17 -53.64 56.06 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.833 0.349 . . . . 0.0 110.321 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.52 ' O ' ' O ' ' B' ' 150' ' ' ALA . 39.0 tp -45.8 -29.45 1.34 Allowed 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.548 -179.703 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 150' ' ' ALA . . . . . 0.52 ' O ' ' O ' ' B' ' 149' ' ' LEU . . . -55.46 -125.54 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.36 179.535 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 151' ' ' THR . . . . . 0.463 ' O ' ' O ' ' B' ' 150' ' ' ALA . 90.9 m 56.25 112.73 0.02 OUTLIER Pre-proline 0 N--CA 1.446 -0.633 0 CA-C-N 116.508 -0.314 . . . . 0.0 110.326 179.332 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -48.56 -49.14 15.32 Favored 'Trans proline' 0 C--N 1.305 -1.731 0 C-N-CA 122.47 2.113 . . . . 0.0 112.811 -179.284 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 46.0 m -61.49 -46.64 89.15 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.043 -178.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 54.0 ttm-85 -61.33 -44.88 96.45 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.669 -178.541 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 155' ' ' LEU . . . . . . . . . . . . . 1.8 tt -60.47 -52.63 64.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.342 -178.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 11.3 tpt -51.17 -47.56 62.12 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 120.607 -0.437 . . . . 0.0 109.981 -179.59 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 35.5 mm -63.52 -42.67 96.98 Favored 'Isoleucine or valine' 0 C--O 1.247 0.967 0 CA-C-O 121.123 0.487 . . . . 0.0 110.636 179.216 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.57 -42.84 99.8 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.796 -179.447 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 9.2 m -59.15 -41.92 89.5 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.786 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 60.2 tp60 -56.56 -45.77 81.1 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 121.002 0.429 . . . . 0.0 110.298 179.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 161' ' ' LEU . . . . . . . . . . . . . 12.7 mt -65.7 -38.3 88.87 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.195 178.316 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 162' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -55.29 -44.27 75.57 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.581 -178.59 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -63.69 -39.24 93.83 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.233 179.214 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . -172.66 155.53 23.3 Favored Glycine 0 CA--C 1.528 0.884 0 N-CA-C 111.111 -0.796 . . . . 0.0 111.111 179.547 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 165' ' ' PRO . . . . . 0.43 ' O ' ' O ' ' B' ' 166' ' ' LEU . 49.4 Cg_endo -70.74 -75.56 0.01 OUTLIER 'Trans proline' 0 C--N 1.31 -1.453 0 C-N-CA 122.761 2.307 . . . . 0.0 112.583 179.736 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 166' ' ' LEU . . . . . 0.43 ' O ' ' O ' ' B' ' 165' ' ' PRO . 0.4 OUTLIER 60.08 144.07 0.05 OUTLIER Pre-proline 0 C--N 1.32 -0.675 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.028 178.319 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -66.6 167.14 19.81 Favored 'Trans proline' 0 C--N 1.305 -1.757 0 C-N-CA 122.58 2.186 . . . . 0.0 112.127 179.504 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 168' ' ' VAL . . . . . 0.464 ' O ' ' OE1' ' B' ' 179' ' ' GLN . 55.0 t -58.24 -41.93 82.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.897 -179.923 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 169' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -60.2 -41.74 93.63 Favored 'General case' 0 C--O 1.247 0.931 0 CA-C-O 121.501 0.667 . . . . 0.0 110.701 179.69 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -64.5 -38.45 91.06 Favored 'General case' 0 C--O 1.239 0.527 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.127 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 18.9 mt -62.14 -36.1 80.78 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.356 179.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 172' ' ' ALA . . . . . 0.474 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -60.66 -46.27 90.98 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.922 178.936 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -57.76 -48.13 80.54 Favored 'General case' 0 C--O 1.236 0.342 0 C-N-CA 120.553 -0.459 . . . . 0.0 110.285 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -65.03 -45.57 84.88 Favored 'General case' 0 C--O 1.232 0.163 0 C-N-CA 120.696 -0.402 . . . . 0.0 110.633 179.712 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 97.0 mt -96.8 -79.08 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.604 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 176' ' ' GLY . . . . . 0.474 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 156.86 103.3 0.2 Allowed Glycine 0 CA--C 1.525 0.666 0 N-CA-C 110.74 -0.944 . . . . 0.0 110.74 -179.683 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 177' ' ' MET . . . . . 0.538 ' O ' ' NE2' ' B' ' 179' ' ' GLN . 74.7 mtp 41.35 -113.16 0.18 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.181 0.515 . . . . 0.0 110.578 179.823 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 50.09 11.9 0.07 Allowed 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.305 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 179' ' ' GLN . . . . . 0.538 ' NE2' ' O ' ' B' ' 177' ' ' MET . 2.7 mm-40 -48.74 -29.33 4.37 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.752 179.778 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 38.9 m -73.04 -33.93 65.99 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.307 179.704 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -70.02 -38.87 76.02 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.119 -178.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 182' ' ' VAL . . . . . 0.445 ' H ' HG23 ' B' ' 182' ' ' VAL . 11.0 m -71.42 -47.19 60.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.483 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 10.5 t -57.73 -44.1 85.77 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 86.1 t60 -65.58 -51.71 57.68 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.809 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -60.99 -41.54 96.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.534 179.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 7.5 tp -59.53 -44.21 93.26 Favored 'General case' 0 C--O 1.216 -0.665 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.201 -179.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 72.9 ttt180 -60.09 -42.64 95.07 Favored 'General case' 0 C--O 1.242 0.671 0 CA-C-O 120.991 0.424 . . . . 0.0 110.414 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 88.7 t -59.46 -54.46 34.08 Favored 'Isoleucine or valine' 0 C--O 1.232 0.135 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.012 -179.211 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 189' ' ' LEU . . . . . 0.456 ' N ' ' CD2' ' B' ' 189' ' ' LEU . 4.1 mm? -64.42 -38.08 89.78 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.572 178.872 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 61.2 ttt85 -51.23 -39.72 57.25 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.321 -179.608 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -60.36 -40.1 89.56 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.809 0.337 . . . . 0.0 110.237 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 192' ' ' LEU . . . . . . . . . . . . . 7.4 mt -71.59 -37.72 70.96 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.489 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 95.19 42.5 3.73 Favored Glycine 0 CA--C 1.522 0.502 0 N-CA-C 110.766 -0.934 . . . . 0.0 110.766 -179.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 5.1 tp -103.99 -9.55 18.77 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.794 0.33 . . . . 0.0 110.921 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 3.4 m -135.71 159.78 39.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.659 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 196' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -155.2 176.39 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.823 -179.83 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 197' ' ' GLY . . . . . . . . . . . . . . . -145.47 158.3 27.61 Favored Glycine 0 CA--C 1.52 0.397 0 N-CA-C 110.723 -0.951 . . . . 0.0 110.723 179.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -124.19 137.98 54.47 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-O 120.673 0.273 . . . . 0.0 110.368 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 61.6 ttm-85 -90.21 133.46 34.9 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.466 179.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 200' ' ' ALA . . . . . . . . . . . . . . . -149.0 134.2 18.29 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.568 179.336 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 201' ' ' GLY . . . . . . . . . . . . . . . 46.0 -113.06 0.94 Allowed Glycine 0 CA--C 1.52 0.376 0 N-CA-C 110.809 -0.916 . . . . 0.0 110.809 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 202' ' ' ARG . . . . . . . . . . . . . 84.4 mtp180 -118.76 32.69 6.0 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 120.708 0.289 . . . . 0.0 110.416 179.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 64.2 m -156.99 173.18 17.41 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 121.135 0.493 . . . . 0.0 110.334 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 204' ' ' ILE . . . . . 0.421 ' C ' ' CD1' ' B' ' 204' ' ' ILE . 1.1 pp -136.87 160.18 36.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.352 179.787 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 3.0 m -120.95 129.3 75.84 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.719 178.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 71.9 m-85 -90.37 118.33 29.78 Favored 'General case' 0 C--O 1.219 -0.533 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.005 -179.776 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 63.7 m -133.46 152.68 51.94 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.013 0.435 . . . . 0.0 110.327 -179.309 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 208' ' ' LEU . . . . . 0.689 ' CD2' ' H ' ' B' ' 208' ' ' LEU . 0.5 OUTLIER -73.37 136.52 44.39 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.652 179.845 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 63.4 t80 -61.68 -47.65 84.36 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.554 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -90.29 129.36 36.53 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.695 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 23.6 m -94.02 -31.06 14.39 Favored 'General case' 0 C--O 1.244 0.808 0 CA-C-O 121.334 0.587 . . . . 0.0 110.304 179.43 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 212' ' ' HIS . . . . . 0.55 ' CG ' ' CD2' ' A' ' 104' ' ' HIS . 75.3 m80 -54.44 -45.09 73.0 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 115.89 -0.595 . . . . 0.0 109.995 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 213' ' ' VAL . . . . . 0.438 ' CG1' ' N ' ' B' ' 214' ' ' ALA . 13.1 p -52.82 -43.67 46.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.054 0.454 . . . . 0.0 110.124 179.836 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 214' ' ' ALA . . . . . 0.438 ' N ' ' CG1' ' B' ' 213' ' ' VAL . . . -57.69 -38.12 74.64 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.014 179.053 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 57.2 tt0 -62.72 -39.5 94.26 Favored 'General case' 0 C--O 1.238 0.459 0 CA-C-O 121.258 0.551 . . . . 0.0 110.119 179.318 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 216' ' ' LEU . . . . . . . . . . . . . 48.9 mt -61.38 -44.87 96.41 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.298 179.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 217' ' ' LEU . . . . . 0.401 ' N ' ' CD2' ' B' ' 217' ' ' LEU . 4.1 mm? -66.45 -37.3 84.84 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.886 178.383 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -57.59 -47.36 82.32 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.14 -179.042 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 219' ' ' GLU . . . . . 0.457 ' OE2' ' OE2' ' A' ' 100' ' ' GLU . 94.6 mt-10 -69.91 -51.5 32.49 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.607 179.185 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -53.64 -47.68 70.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.459 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 4.4 mm -62.07 -44.76 99.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.432 -179.251 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 222' ' ' TYR . . . . . 0.593 ' CE1' ' NE2' ' B' ' 226' ' ' HIS . 74.5 t80 -60.09 -47.37 86.16 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.943 0.402 . . . . 0.0 110.427 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 223' ' ' HIS . . . . . 0.579 ' CD2' ' CG ' ' A' ' 93' ' ' HIS . 17.7 t-80 -56.75 -39.24 73.64 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.586 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 32.9 t -76.74 -40.53 48.19 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.066 179.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 82.9 tt0 -56.78 -34.85 68.03 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.355 -179.254 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 226' ' ' HIS . . . . . 0.593 ' NE2' ' CE1' ' B' ' 222' ' ' TYR . 8.0 m-70 -80.21 -1.77 42.02 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.483 179.803 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 227' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -144.64 105.15 4.12 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.626 179.797 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 228' ' ' HIS . . . . . 0.455 ' C ' ' ND1' ' B' ' 228' ' ' HIS . 7.4 p80 -160.41 4.29 0.08 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.709 179.463 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 229' ' ' LEU . . . . . . . . . . . . . 10.9 mp -62.09 -41.88 98.64 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.455 -179.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 230' ' ' GLY . . . . . 0.405 ' O ' ' C ' ' B' ' 231' ' ' LEU . . . -74.07 -57.43 4.8 Favored Glycine 0 CA--C 1.521 0.437 0 N-CA-C 110.865 -0.894 . . . . 0.0 110.865 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 231' ' ' LEU . . . . . 0.405 ' C ' ' O ' ' B' ' 230' ' ' GLY . 30.7 tp 38.08 72.35 0.13 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.802 0.334 . . . . 0.0 110.679 -179.844 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 232' ' ' SER . . . . . . . . . . . . . 31.4 t -104.1 121.66 43.69 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.916 0.389 . . . . 0.0 110.312 -179.379 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 233' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -94.44 116.96 29.41 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.535 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 234' ' ' ARG . . . . . 0.523 ' O ' ' CG ' ' B' ' 235' ' ' HIS . 30.2 mmt180 -85.2 93.7 8.72 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.47 -179.904 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 235' ' ' HIS . . . . . 0.523 ' CG ' ' O ' ' B' ' 234' ' ' ARG . 63.7 m-70 -160.81 57.18 0.84 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.528 179.836 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 236' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -70.35 155.32 64.24 Favored 'Trans proline' 0 C--N 1.307 -1.62 0 C-N-CA 122.86 2.374 . . . . 0.0 112.137 -179.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 237' ' ' SER . . . . . . . . . . . . . 35.7 p -156.84 164.54 37.96 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.606 179.563 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 238' ' ' ALA . . . . . . . . . . . . . . . 55.15 42.11 30.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.564 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.771 0 CA-C-O 118.012 -1.438 . . . . 0.0 110.906 179.979 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.392 0 N-CA-C 109.556 -1.418 . . . . 0.0 109.556 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.425 ' O ' ' ND1' ' A' ' 3' ' ' HIS . 10.3 p80 -155.55 148.48 24.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.83 0.348 . . . . 0.0 110.356 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 140.59 -37.41 1.68 Allowed Glycine 0 N--CA 1.462 0.431 0 N-CA-C 110.949 -0.861 . . . . 0.0 110.949 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 75.0 t -127.43 132.37 69.43 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 CA-C-O 120.925 0.393 . . . . 0.0 110.414 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 45.48 -165.94 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.472 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 79.92 22.3 64.01 Favored Glycine 0 CA--C 1.524 0.611 0 N-CA-C 111.013 -0.835 . . . . 0.0 111.013 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 37.5 mmt180 -75.65 100.24 4.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.026 0.441 . . . . 0.0 110.66 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.457 ' O ' ' O ' ' A' ' 10' ' ' ARG . 77.2 m-20 54.12 26.65 6.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.505 179.866 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.457 ' O ' ' O ' ' A' ' 9' ' ' ASN . 89.5 mtt180 56.74 151.16 0.06 OUTLIER Pre-proline 0 C--N 1.326 -0.424 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.832 179.597 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -67.41 144.76 68.86 Favored 'Trans proline' 0 N--CA 1.494 1.535 0 C-N-CA 122.511 2.141 . . . . 0.0 112.003 179.4 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.7 p -165.03 34.5 0.06 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.642 179.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -162.26 70.97 2.25 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.696 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -53.61 133.54 54.23 Favored 'Trans proline' 0 C--N 1.307 -1.637 0 C-N-CA 122.826 2.35 . . . . 0.0 111.772 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.527 ' O ' ' N ' ' A' ' 17' ' ' SER . 56.0 mt -85.48 174.01 9.81 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.443 179.928 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.523 ' O ' ' N ' ' A' ' 19' ' ' ALA . 98.9 m-20 -43.3 -16.82 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.722 179.76 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.527 ' N ' ' O ' ' A' ' 15' ' ' LEU . 91.3 p -38.31 -38.5 0.36 Allowed 'General case' 0 C--O 1.24 0.583 0 CA-C-O 121.231 0.539 . . . . 0.0 110.6 -179.509 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 25.1 pt20 -65.33 -44.02 89.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.328 179.144 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.523 ' N ' ' O ' ' A' ' 16' ' ' ASP . . . -63.67 -28.6 70.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.202 179.456 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.36 -51.73 48.64 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.239 179.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.06 -46.5 89.36 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.71 179.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -54.48 -50.58 67.42 Favored 'General case' 0 C--O 1.241 0.648 0 CA-C-O 121.177 0.513 . . . . 0.0 110.471 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 92.2 t -62.76 -44.73 99.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.42 179.573 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -53.6 -44.05 69.11 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 10.9 t -59.91 -43.88 94.6 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 11.1 m -63.73 -46.95 83.06 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.025 0.441 . . . . 0.0 110.39 179.289 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 95.4 mt -67.26 -21.12 65.73 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.643 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 58.2 tt0 -75.81 -56.36 4.75 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.637 179.329 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.12 -54.61 45.02 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.448 -179.466 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.486 ' O ' ' O ' ' A' ' 31' ' ' ALA . 93.3 mt -47.56 -41.96 22.56 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.557 -179.205 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.517 ' O ' ' CB ' ' A' ' 32' ' ' THR . . . -50.04 -174.97 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.017 179.752 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.517 ' CB ' ' O ' ' A' ' 31' ' ' ALA . 1.0 OUTLIER 88.37 118.3 0.03 OUTLIER Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.031 179.961 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -46.7 -46.58 17.69 Favored 'Trans proline' 0 N--CA 1.496 1.659 0 C-N-CA 122.368 2.045 . . . . 0.0 113.113 -178.662 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 11.6 t -58.97 -44.5 91.55 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.813 -179.118 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 22.5 mmt85 -62.0 -46.15 90.46 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 120.675 -0.41 . . . . 0.0 110.984 -179.315 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.467 ' CD2' ' O ' ' A' ' 30' ' ' LEU . 4.2 mm? -62.87 -47.31 83.88 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.974 -179.567 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.444 ' C ' ' SD ' ' A' ' 37' ' ' MET . 14.3 tmm? -58.32 -49.22 77.97 Favored 'General case' 0 C--N 1.32 -0.677 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.545 -179.673 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.409 HG23 HD12 ' A' ' 38' ' ' ILE . 32.9 mm -63.96 -44.62 97.96 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.789 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 49.3 mt -62.12 -42.35 99.14 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.754 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.422 ' OG1' ' O ' ' A' ' 36' ' ' LEU . 19.5 m -60.16 -41.32 92.56 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.2 -0.455 . . . . 0.0 109.896 179.554 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.539 ' N ' ' OE1' ' A' ' 41' ' ' GLN . 0.1 OUTLIER -57.85 -49.68 75.86 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.262 -0.426 . . . . 0.0 109.928 179.992 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 98.3 mt -63.77 -42.55 97.76 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.455 -0.498 . . . . 0.0 110.685 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 72.7 ttp85 -71.53 -21.12 61.95 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.646 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 62.0 t-20 -62.46 -41.22 98.61 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.934 0.397 . . . . 0.0 110.48 -179.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 159.34 -166.59 34.78 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 111.088 -0.805 . . . . 0.0 111.088 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_exo -73.51 115.51 4.36 Favored 'Trans proline' 0 N--CA 1.492 1.415 0 C-N-CA 122.888 2.392 . . . . 0.0 112.151 179.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.449 ' O ' ' O ' ' A' ' 48' ' ' PRO . 0.3 OUTLIER -158.34 84.61 2.58 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.106 179.911 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . 0.449 ' O ' ' O ' ' A' ' 47' ' ' LEU . 51.2 Cg_exo -51.14 -166.57 0.0 OUTLIER 'Trans proline' 0 C--N 1.303 -1.855 0 C-N-CA 122.471 2.114 . . . . 0.0 112.385 179.699 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 55.0 t -59.69 -51.06 77.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 121.072 0.463 . . . . 0.0 111.291 -179.265 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -57.33 -44.84 84.57 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.257 0.551 . . . . 0.0 109.921 179.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 -65.09 -33.99 77.34 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.592 -0.522 . . . . 0.0 109.592 179.429 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.05 -43.26 99.21 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 120.541 -0.463 . . . . 0.0 110.09 -179.777 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.81 -45.04 96.01 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.587 179.407 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 41.1 tp10 -65.03 -30.42 71.4 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.369 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -70.28 -53.98 14.56 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.853 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 90.2 mt -94.26 -68.67 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.247 179.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 134.2 97.72 0.6 Allowed Glycine 0 C--N 1.332 0.322 0 N-CA-C 111.348 -0.701 . . . . 0.0 111.348 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 65.6 mtt 60.02 97.38 0.03 OUTLIER 'General case' 0 CA--C 1.519 -0.212 0 C-N-CA 120.819 -0.352 . . . . 0.0 110.928 178.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -179.6 19.15 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.488 179.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 56.0 mt-30 -54.4 -26.72 32.16 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.365 0.602 . . . . 0.0 110.797 -179.047 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 78.1 p -74.39 -31.48 62.36 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.237 179.353 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -74.6 -38.98 62.46 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.446 -178.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.407 ' CG1' ' N ' ' A' ' 64' ' ' SER . 7.6 p -73.81 -50.63 28.21 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 CA-C-N 116.515 -0.312 . . . . 0.0 110.381 179.898 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.407 ' N ' ' CG1' ' A' ' 63' ' ' VAL . 45.4 t -58.37 -43.76 88.58 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 120.509 -0.477 . . . . 0.0 110.362 -179.787 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 55.6 t-80 -67.0 -45.55 77.24 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.859 179.686 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -63.86 -48.49 76.51 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.974 -179.192 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -61.84 -44.55 96.62 Favored 'General case' 0 CA--C 1.503 -0.829 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.877 -179.343 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 60.8 ttp180 -59.55 -44.35 93.27 Favored 'General case' 0 C--N 1.315 -0.891 0 CA-C-O 121.059 0.457 . . . . 0.0 110.377 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 47.9 t -59.24 -51.83 67.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 C-N-CA 120.344 -0.542 . . . . 0.0 110.055 -179.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 95.6 mt -67.9 -27.68 66.85 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.976 0.417 . . . . 0.0 110.467 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 74.2 ttt180 -62.31 -42.43 99.36 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.408 -179.695 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 -60.56 -44.52 96.08 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 120.599 -0.441 . . . . 0.0 110.357 -179.672 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 10.2 mt -65.3 -39.01 91.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.318 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 99.4 60.05 0.87 Allowed Glycine 0 N--CA 1.462 0.403 0 N-CA-C 110.717 -0.953 . . . . 0.0 110.717 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 27.9 tp -118.53 -15.91 9.55 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 121.006 0.431 . . . . 0.0 110.352 -179.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 21.2 m -131.37 163.64 36.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.087 0.47 . . . . 0.0 110.281 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.487 ' CG1' ' N ' ' A' ' 78' ' ' GLY . 91.9 t -143.62 163.22 15.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.803 -179.481 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . 0.487 ' N ' ' CG1' ' A' ' 77' ' ' VAL . . . -108.56 161.24 13.35 Favored Glycine 0 CA--C 1.524 0.597 0 N-CA-C 110.584 -1.006 . . . . 0.0 110.584 179.606 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -142.02 111.25 6.41 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.761 0.315 . . . . 0.0 110.568 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 73.8 ttp85 -75.07 128.43 35.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.587 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.434 ' O ' ' O ' ' A' ' 84' ' ' SER . . . -171.56 142.99 1.69 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.588 179.816 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 53.06 46.88 61.25 Favored Glycine 0 CA--C 1.525 0.665 0 N-CA-C 110.966 -0.854 . . . . 0.0 110.966 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 83.6 mtp180 50.42 29.29 3.81 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.77 0.319 . . . . 0.0 110.75 -179.735 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' SER . . . . . 0.434 ' O ' ' O ' ' A' ' 81' ' ' ALA . 29.8 t -153.03 139.96 19.14 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-O 121.023 0.44 . . . . 0.0 110.09 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 1.2 pp -92.69 148.01 4.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.293 179.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 70.2 t -122.38 134.23 66.23 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.26 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.064 179.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 64.4 m-85 -90.93 124.6 35.33 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.387 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 65.5 m -138.67 158.79 43.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.516 -179.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 18.2 mt -66.88 140.47 57.79 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.315 -179.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.405 ' CD1' ' C ' ' A' ' 90' ' ' TYR . 14.5 t80 -57.12 -50.7 71.98 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.642 -179.76 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -100.98 134.27 44.22 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.879 0.371 . . . . 0.0 110.608 -179.486 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 70.8 p -74.26 -26.66 60.34 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.363 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 74.0 m80 -56.36 -43.69 79.38 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.338 -179.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 75.0 t -56.94 -43.06 79.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -179.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.37 -43.03 99.57 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.252 179.497 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 68.1 tp60 -64.34 -42.59 96.18 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.177 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 12.6 tp -59.02 -43.66 91.61 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.964 -179.373 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 90.4 mt -64.34 -39.71 94.44 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.191 179.444 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -58.92 -42.39 89.56 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.437 -179.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -66.16 -53.71 34.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.514 179.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.95 -41.06 86.54 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.021 0.438 . . . . 0.0 110.49 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 4.0 mm -61.63 -44.58 98.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.519 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' TYR . . . . . 0.508 ' O ' ' ND1' ' A' ' 107' ' ' HIS . 4.0 m-85 -66.21 -38.29 87.61 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.139 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 3.8 t60 -58.64 -42.81 89.19 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.589 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 29.8 t -79.45 -36.61 38.58 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.036 0.446 . . . . 0.0 111.22 179.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 48.1 tp10 -55.68 -40.77 72.76 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.433 -178.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . 0.508 ' ND1' ' O ' ' A' ' 103' ' ' TYR . 36.0 m80 -49.85 -70.43 0.09 Allowed 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 -179.196 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 1.8 tt -177.93 112.93 0.08 Allowed 'General case' 0 C--N 1.328 -0.362 0 O-C-N 123.336 0.397 . . . . 0.0 110.404 179.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 47.4 t-80 -156.49 100.71 1.97 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.7 179.527 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 95.4 mt -63.29 -41.79 99.01 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.433 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 45.7 76.36 0.13 Allowed Glycine 0 CA--C 1.52 0.363 0 N-CA-C 111.058 -0.817 . . . . 0.0 111.058 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 44.5 tp -79.93 127.25 32.04 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.851 -0.34 . . . . 0.0 110.485 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 9.8 p -74.99 147.57 40.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.686 179.568 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 91.5 m-20 -98.47 1.02 46.31 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.536 179.705 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 95.7 mtt-85 -65.6 -101.77 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.674 -179.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 11.3 m-70 43.63 71.6 1.42 Allowed Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.515 -179.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -58.9 144.85 98.65 Favored 'Trans proline' 0 C--N 1.306 -1.666 0 C-N-CA 122.724 2.283 . . . . 0.0 111.805 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 65.7 m -116.96 121.82 42.49 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.638 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -70.22 143.46 52.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.372 179.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.703 0 CA-C-O 118.031 -1.427 . . . . 0.0 110.991 -179.932 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.233 0 N-CA-C 109.46 -1.456 . . . . 0.0 109.46 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 13.6 p80 -151.48 150.91 30.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.801 0.334 . . . . 0.0 110.331 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 123' ' ' GLY . . . . . . . . . . . . . . . 139.09 -35.54 1.97 Allowed Glycine 0 CA--C 1.521 0.453 0 N-CA-C 110.934 -0.867 . . . . 0.0 110.934 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 124' ' ' VAL . . . . . 0.418 ' O ' ' O ' ' B' ' 125' ' ' GLU . 79.5 t -128.37 134.56 64.56 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 CA-C-O 120.903 0.382 . . . . 0.0 110.381 -179.802 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 125' ' ' GLU . . . . . 0.418 ' O ' ' O ' ' B' ' 124' ' ' VAL . 97.3 mt-10 42.9 -166.57 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.618 179.704 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 80.64 21.4 64.06 Favored Glycine 0 CA--C 1.524 0.648 0 N-CA-C 110.936 -0.866 . . . . 0.0 110.936 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 127' ' ' ARG . . . . . . . . . . . . . 35.9 mmt180 -73.38 100.7 3.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.84 0.353 . . . . 0.0 110.719 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 128' ' ' ASN . . . . . 0.478 ' O ' ' O ' ' B' ' 129' ' ' ARG . 82.9 m-20 53.94 27.31 7.17 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.607 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 129' ' ' ARG . . . . . 0.478 ' O ' ' O ' ' B' ' 128' ' ' ASN . 86.3 mtt180 56.01 150.63 0.06 OUTLIER Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.982 179.751 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo -67.06 144.92 71.59 Favored 'Trans proline' 0 C--N 1.307 -1.609 0 C-N-CA 122.511 2.141 . . . . 0.0 112.04 179.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 59.5 p -164.04 28.28 0.08 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.677 179.618 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 132' ' ' ALA . . . . . . . . . . . . . . . -157.18 74.03 4.41 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.771 -179.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 133' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_exo -55.32 137.1 76.35 Favored 'Trans proline' 0 C--N 1.307 -1.651 0 C-N-CA 122.829 2.353 . . . . 0.0 111.659 179.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . 0.534 ' O ' ' N ' ' B' ' 136' ' ' SER . 55.2 mt -88.81 174.55 7.91 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.393 179.773 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 135' ' ' ASP . . . . . 0.503 ' O ' ' N ' ' B' ' 138' ' ' ALA . 94.4 m-20 -42.89 -17.08 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.624 179.68 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 136' ' ' SER . . . . . 0.534 ' N ' ' O ' ' B' ' 134' ' ' LEU . 69.3 p -38.35 -38.65 0.38 Allowed 'General case' 0 C--O 1.239 0.512 0 CA-C-O 121.285 0.564 . . . . 0.0 110.423 -179.577 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 137' ' ' GLN . . . . . 0.419 ' CG ' ' N ' ' B' ' 138' ' ' ALA . 23.5 pt20 -65.9 -45.18 82.93 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.398 179.174 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 138' ' ' ALA . . . . . 0.503 ' N ' ' O ' ' B' ' 135' ' ' ASP . . . -63.18 -28.16 69.86 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.163 179.708 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.28 -50.82 51.13 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.28 179.703 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -60.33 -46.32 90.3 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.534 179.724 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -54.39 -51.32 65.21 Favored 'General case' 0 C--O 1.241 0.646 0 CA-C-O 121.27 0.557 . . . . 0.0 110.544 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 142' ' ' VAL . . . . . . . . . . . . . 90.5 t -62.7 -45.88 97.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.451 179.686 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -52.05 -44.58 64.32 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 36.7 t -59.43 -44.44 92.9 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.039 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 8.1 m -63.68 -47.06 82.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.485 179.511 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 93.6 mt -66.53 -20.69 66.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.621 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 147' ' ' GLN . . . . . . . . . . . . . 58.8 tt0 -75.78 -56.85 4.29 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.585 179.287 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -57.93 -54.71 43.83 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.362 -179.424 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.483 ' O ' ' O ' ' B' ' 150' ' ' ALA . 94.2 mt -46.93 -41.7 16.49 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.359 -179.245 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 150' ' ' ALA . . . . . 0.519 ' O ' ' CB ' ' B' ' 151' ' ' THR . . . -50.6 -174.33 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.147 -0.479 . . . . 0.0 109.978 179.651 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 151' ' ' THR . . . . . 0.519 ' CB ' ' O ' ' B' ' 150' ' ' ALA . 1.0 OUTLIER 88.14 117.84 0.03 OUTLIER Pre-proline 0 CA--C 1.538 0.518 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 179.833 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -46.74 -46.47 18.03 Favored 'Trans proline' 0 N--CA 1.495 1.586 0 C-N-CA 122.322 2.015 . . . . 0.0 113.063 -178.518 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 48.1 t -58.97 -44.42 91.53 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.969 -179.253 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 20.7 mmt85 -61.78 -45.91 91.84 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.739 -0.385 . . . . 0.0 111.042 -179.463 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 155' ' ' LEU . . . . . 0.461 ' CD2' ' O ' ' B' ' 149' ' ' LEU . 4.2 mm? -62.76 -47.71 82.35 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 120.598 -0.441 . . . . 0.0 111.073 -179.853 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 156' ' ' MET . . . . . 0.44 ' C ' ' SD ' ' B' ' 156' ' ' MET . 14.4 tmm? -58.29 -49.24 77.84 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 120.337 -0.545 . . . . 0.0 110.612 -179.859 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 5.9 mm -64.4 -44.91 97.16 Favored 'Isoleucine or valine' 0 C--O 1.239 0.507 0 CA-C-O 121.098 0.475 . . . . 0.0 110.823 -179.504 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 57.7 mt -62.09 -41.77 98.53 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.599 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 159' ' ' THR . . . . . 0.421 ' OG1' ' O ' ' B' ' 155' ' ' LEU . 28.0 m -59.75 -41.9 92.02 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.179 -0.464 . . . . 0.0 109.815 179.292 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 160' ' ' GLN . . . . . 0.55 ' OE1' ' N ' ' B' ' 160' ' ' GLN . 0.0 OUTLIER -58.02 -49.24 77.55 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.854 -0.425 . . . . 0.0 109.854 179.958 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 161' ' ' LEU . . . . . . . . . . . . . 97.5 mt -63.95 -42.75 97.21 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 120.373 -0.531 . . . . 0.0 110.573 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 162' ' ' ARG . . . . . . . . . . . . . 72.5 ttp85 -71.3 -21.0 62.13 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.51 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 59.4 t-20 -63.18 -41.87 99.27 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.579 -179.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . 162.26 -165.44 36.01 Favored Glycine 0 CA--C 1.528 0.853 0 N-CA-C 111.017 -0.833 . . . . 0.0 111.017 -179.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -79.06 112.98 3.15 Favored 'Trans proline' 0 C--N 1.31 -1.486 0 C-N-CA 122.958 2.439 . . . . 0.0 111.769 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 166' ' ' LEU . . . . . 0.436 ' O ' ' O ' ' B' ' 167' ' ' PRO . 0.3 OUTLIER -153.35 85.86 4.11 Favored Pre-proline 0 C--N 1.325 -0.486 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.264 -178.935 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 167' ' ' PRO . . . . . 0.436 ' O ' ' O ' ' B' ' 166' ' ' LEU . 51.4 Cg_exo -50.69 -167.94 0.0 OUTLIER 'Trans proline' 0 C--N 1.306 -1.692 0 C-N-CA 122.607 2.205 . . . . 0.0 112.243 179.76 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . 80.0 t -59.59 -50.41 80.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.973 -179.209 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 169' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -57.54 -44.77 85.44 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.281 0.562 . . . . 0.0 109.976 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 -65.51 -34.69 78.85 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.632 179.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.62 -44.47 96.92 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 120.466 -0.493 . . . . 0.0 110.02 -179.614 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 172' ' ' ALA . . . . . . . . . . . . . . . -60.39 -44.33 95.78 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 179.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 45.3 tp10 -64.89 -30.65 71.66 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.388 179.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -69.92 -54.46 13.3 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.846 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 93.1 mt -93.56 -68.18 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.293 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . 133.46 96.75 0.6 Allowed Glycine 0 C--N 1.332 0.333 0 N-CA-C 111.317 -0.713 . . . . 0.0 111.317 -179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 61.6 mtt 61.91 96.68 0.03 OUTLIER 'General case' 0 CA--C 1.52 -0.19 0 CA-C-O 120.713 0.292 . . . . 0.0 110.765 178.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -178.93 19.02 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.58 179.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 56.0 mt-30 -54.23 -27.24 33.36 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.36 0.6 . . . . 0.0 110.848 -179.059 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 78.5 p -74.41 -32.71 62.77 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.394 179.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -73.29 -38.75 65.77 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.584 -178.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 7.3 p -73.42 -49.73 35.04 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.509 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.436 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 43.0 t -58.09 -43.77 87.26 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 120.706 -0.397 . . . . 0.0 110.129 -179.533 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 54.7 t-80 -67.16 -45.01 78.29 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.618 179.687 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -63.65 -49.76 71.97 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.708 -179.411 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -61.31 -44.27 97.48 Favored 'General case' 0 CA--C 1.502 -0.888 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.789 -179.532 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 60.5 ttp180 -59.62 -44.9 93.28 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.143 0.497 . . . . 0.0 110.469 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 44.2 t -58.93 -52.17 63.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.196 -179.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 86.1 mt -67.82 -28.38 67.52 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.938 0.399 . . . . 0.0 110.361 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 74.9 ttt180 -61.52 -42.34 98.67 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.412 -179.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -60.49 -45.36 94.04 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.71 -0.396 . . . . 0.0 110.437 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 192' ' ' LEU . . . . . . . . . . . . . 10.0 mt -65.03 -40.13 94.38 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.315 179.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 101.0 53.85 1.0 Allowed Glycine 0 N--CA 1.462 0.412 0 N-CA-C 111.005 -0.838 . . . . 0.0 111.005 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 14.9 tp -111.94 -15.06 13.4 Favored 'General case' 0 N--CA 1.462 0.125 0 CA-C-O 120.885 0.374 . . . . 0.0 110.618 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 23.9 m -132.13 163.76 36.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 121.015 0.436 . . . . 0.0 110.349 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 196' ' ' VAL . . . . . 0.486 ' CG1' ' N ' ' B' ' 197' ' ' GLY . 96.4 t -144.33 163.42 14.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.686 -179.6 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 197' ' ' GLY . . . . . 0.486 ' N ' ' CG1' ' B' ' 196' ' ' VAL . . . -109.21 160.04 13.74 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.534 -1.026 . . . . 0.0 110.534 179.598 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -140.82 110.92 6.6 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.738 0.304 . . . . 0.0 110.734 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 73.3 ttp85 -73.62 128.28 35.08 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.462 179.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 200' ' ' ALA . . . . . 0.435 ' O ' ' O ' ' B' ' 203' ' ' SER . . . -171.65 139.71 1.25 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.513 179.769 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 201' ' ' GLY . . . . . . . . . . . . . . . 55.37 48.78 67.51 Favored Glycine 0 CA--C 1.525 0.7 0 N-CA-C 110.878 -0.889 . . . . 0.0 110.878 179.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 202' ' ' ARG . . . . . . . . . . . . . 84.4 mtp180 49.04 26.96 1.53 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.631 0.253 . . . . 0.0 110.563 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 203' ' ' SER . . . . . 0.435 ' O ' ' O ' ' B' ' 200' ' ' ALA . 33.1 t -150.26 139.75 21.49 Favored 'General case' 0 CA--C 1.52 -0.187 0 CA-C-O 121.116 0.484 . . . . 0.0 110.179 179.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 1.3 pp -93.14 146.73 6.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.287 179.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 69.8 t -120.89 134.87 62.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.085 179.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 59.0 m-85 -91.8 125.12 36.39 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.512 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 67.8 m -139.26 158.53 43.99 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.502 -179.549 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . 15.9 mt -66.91 138.91 57.64 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.457 -179.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 15.2 t80 -54.77 -51.99 64.0 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.674 -179.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 63.8 m-20 -99.85 135.36 41.39 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.827 0.346 . . . . 0.0 110.673 -179.396 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 76.2 p -75.74 -24.26 56.09 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.374 179.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 212' ' ' HIS . . . . . . . . . . . . . 74.3 m80 -57.32 -43.48 83.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.289 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 74.5 t -57.67 -43.58 83.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 214' ' ' ALA . . . . . . . . . . . . . . . -59.7 -45.61 91.59 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.366 179.478 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 69.5 tp60 -63.63 -41.94 98.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.265 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 216' ' ' LEU . . . . . . . . . . . . . 14.6 tp -59.05 -43.93 91.73 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.025 -179.283 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 82.1 mt -64.51 -39.41 93.73 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.099 179.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -58.82 -42.3 88.89 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.514 -179.778 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 219' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -67.14 -51.43 54.04 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.534 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -59.77 -41.48 91.18 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.062 0.458 . . . . 0.0 110.406 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 4.4 mm -61.78 -44.04 98.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.674 -179.714 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 222' ' ' TYR . . . . . 0.432 ' O ' ' ND1' ' B' ' 226' ' ' HIS . 4.2 m-85 -66.36 -38.53 87.79 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.271 179.936 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 223' ' ' HIS . . . . . . . . . . . . . 3.3 t60 -58.48 -43.08 88.86 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.526 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 37.5 t -77.89 -36.27 49.81 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.9 179.494 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 225' ' ' GLU . . . . . 0.528 ' C ' ' H ' ' B' ' 227' ' ' LEU . 37.0 tp10 -59.86 -30.94 69.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.529 -179.276 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 226' ' ' HIS . . . . . 0.555 ' O ' ' CB ' ' B' ' 227' ' ' LEU . 27.3 m80 -62.55 4.21 0.17 Allowed 'General case' 0 CA--C 1.507 -0.704 0 CA-C-O 118.681 -0.676 . . . . 0.0 111.264 -179.707 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 227' ' ' LEU . . . . . 0.555 ' CB ' ' O ' ' B' ' 226' ' ' HIS . 3.6 tt 96.29 110.67 0.02 OUTLIER 'General case' 0 C--N 1.344 0.361 0 O-C-N 124.589 1.181 . . . . 0.0 110.84 179.834 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 228' ' ' HIS . . . . . . . . . . . . . 48.0 t-80 -152.12 104.04 2.93 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.497 179.26 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 229' ' ' LEU . . . . . . . . . . . . . 82.5 mt -62.4 -42.97 99.84 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.31 -179.124 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . 42.06 74.11 0.19 Allowed Glycine 0 CA--C 1.524 0.652 0 N-CA-C 110.935 -0.866 . . . . 0.0 110.935 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 231' ' ' LEU . . . . . . . . . . . . . 52.6 tp -76.01 129.81 37.44 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.615 -179.672 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 232' ' ' SER . . . . . . . . . . . . . 10.4 p -77.03 151.11 35.7 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.536 179.342 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 233' ' ' ASP . . . . . . . . . . . . . 91.4 m-20 -100.56 1.25 40.72 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.573 179.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 234' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -64.81 -101.91 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.663 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 235' ' ' HIS . . . . . . . . . . . . . 11.4 m-70 43.52 71.54 1.43 Allowed Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.571 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 236' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -59.76 143.09 99.69 Favored 'Trans proline' 0 C--N 1.306 -1.696 0 C-N-CA 122.692 2.261 . . . . 0.0 111.736 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 237' ' ' SER . . . . . . . . . . . . . 66.7 m -115.32 121.5 43.04 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.468 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 238' ' ' ALA . . . . . . . . . . . . . . . -70.31 143.44 52.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.544 179.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.761 0 CA-C-O 118.098 -1.39 . . . . 0.0 110.882 -179.992 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.262 0 N-CA-C 109.512 -1.435 . . . . 0.0 109.512 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -84.65 127.57 34.15 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.811 0.338 . . . . 0.0 110.504 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -88.54 93.43 1.89 Allowed Glycine 0 CA--C 1.526 0.725 0 N-CA-C 110.939 -0.865 . . . . 0.0 110.939 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 19.1 m -73.22 -24.66 20.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 120.898 0.38 . . . . 0.0 110.665 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 17.2 pt-20 -67.41 149.14 50.65 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.648 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -151.87 -101.14 0.21 Allowed Glycine 0 CA--C 1.523 0.581 0 N-CA-C 110.877 -0.889 . . . . 0.0 110.877 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 41.5 ttm180 44.89 90.45 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.695 0.284 . . . . 0.0 110.491 -179.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.535 ' CG ' ' H ' ' A' ' 10' ' ' ARG . 59.3 t30 -141.67 -144.59 0.16 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.417 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.535 ' H ' ' CG ' ' A' ' 9' ' ' ASN . 64.1 mtm180 55.87 57.93 9.85 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.604 -179.75 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -71.63 146.99 50.37 Favored 'Trans proline' 0 C--N 1.31 -1.493 0 C-N-CA 122.677 2.251 . . . . 0.0 112.1 -179.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 44.9 t -161.36 124.28 3.15 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.186 179.579 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.557 ' N ' ' CD ' ' A' ' 14' ' ' PRO . . . 175.37 -45.96 0.0 OUTLIER Pre-proline 0 CA--C 1.533 0.326 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.482 -179.541 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.557 ' CD ' ' N ' ' A' ' 13' ' ' ALA . 52.2 Cg_exo -52.79 -162.13 0.0 OUTLIER 'Trans proline' 0 C--N 1.313 -1.333 0 C-N-CA 122.498 2.132 . . . . 0.0 112.18 -178.712 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.527 ' O ' ' N ' ' A' ' 17' ' ' SER . 70.2 mt -66.39 153.94 41.43 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.153 -179.869 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.525 ' O ' ' N ' ' A' ' 19' ' ' ALA . 99.2 m-20 -43.33 -16.96 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.63 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.527 ' N ' ' O ' ' A' ' 15' ' ' LEU . 86.4 p -38.46 -40.16 0.53 Allowed 'General case' 0 C--O 1.236 0.368 0 CA-C-O 121.239 0.542 . . . . 0.0 110.473 -179.788 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.509 ' N ' ' HG ' ' A' ' 17' ' ' SER . 94.8 mm-40 -65.49 -42.93 91.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.191 179.235 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.525 ' N ' ' O ' ' A' ' 16' ' ' ASP . . . -65.79 -28.77 69.26 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.501 179.407 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.61 -52.84 27.13 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.376 179.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.8 -49.58 76.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.914 0.387 . . . . 0.0 111.153 179.563 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 66.5 tp60 -53.62 -50.11 66.39 Favored 'General case' 0 C--O 1.242 0.682 0 CA-C-O 121.722 0.772 . . . . 0.0 109.996 -179.559 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 57.7 t -62.59 -41.76 93.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.639 -0.709 . . . . 0.0 109.689 179.517 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -50.68 -47.43 58.81 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.176 179.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 40.3 t -60.22 -43.84 95.67 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.318 -0.401 . . . . 0.0 109.982 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 24.2 m -63.24 -51.77 64.87 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.253 -0.579 . . . . 0.0 110.934 179.72 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 88.6 mt -67.76 -21.1 65.28 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.761 -179.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 52.7 tt0 -75.05 -60.56 2.24 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.759 179.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.455 ' O ' ' OG1' ' A' ' 32' ' ' THR . . . -58.33 -53.04 62.74 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.863 -179.063 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.432 ' O ' ' C ' ' A' ' 31' ' ' ALA . 4.0 mm? -51.23 -41.37 60.27 Favored 'General case' 0 CA--C 1.509 -0.634 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 -178.475 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.563 ' O ' ' C ' ' A' ' 32' ' ' THR . . . -39.22 -70.81 0.09 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.431 179.757 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.563 ' C ' ' O ' ' A' ' 31' ' ' ALA . 7.1 p -3.35 107.16 0.03 OUTLIER Pre-proline 0 N--CA 1.48 1.027 0 O-C-N 124.583 1.177 . . . . 0.0 111.018 -179.685 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -47.3 -48.47 15.0 Favored 'Trans proline' 0 C--N 1.307 -1.611 0 C-N-CA 122.073 1.849 . . . . 0.0 113.31 -177.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 11.1 t -57.62 -44.14 85.28 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.659 -179.297 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 38.5 ttm180 -61.18 -45.24 95.43 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 120.643 -0.423 . . . . 0.0 110.71 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 80.3 mt -57.69 -52.28 66.09 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.313 -0.555 . . . . 0.0 110.707 -179.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.439 ' O ' ' OG1' ' A' ' 40' ' ' THR . 53.9 ttp -53.63 -46.23 70.42 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.221 -0.592 . . . . 0.0 110.583 179.412 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 97.5 mt -62.36 -48.03 90.26 Favored 'Isoleucine or valine' 0 C--O 1.239 0.529 0 CA-C-O 121.332 0.587 . . . . 0.0 110.798 -179.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -61.89 -41.56 98.03 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.575 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.439 ' OG1' ' O ' ' A' ' 37' ' ' MET . 37.4 p -61.77 -33.98 75.06 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.988 179.956 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 60.8 tp60 -64.47 -50.49 67.27 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 120.603 -0.439 . . . . 0.0 109.897 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 16.6 mt -62.86 -30.45 71.52 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.495 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 10.8 ttm180 -42.58 -41.29 2.99 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.586 -179.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 95.1 m-20 -62.36 -42.92 99.78 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.981 0.42 . . . . 0.0 110.186 -179.747 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 162.23 178.32 36.01 Favored Glycine 0 CA--C 1.527 0.8 0 C-N-CA 120.559 -0.829 . . . . 0.0 111.361 179.027 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 15.1 Cg_exo -67.33 148.07 79.21 Favored 'Trans proline' 0 N--CA 1.49 1.28 0 C-N-CA 122.85 2.367 . . . . 0.0 111.899 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -164.43 159.4 15.86 Favored Pre-proline 0 CA--C 1.536 0.414 0 C-N-CA 120.262 -0.575 . . . . 0.0 110.793 178.734 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_exo -66.79 149.33 83.48 Favored 'Trans proline' 0 N--CA 1.496 1.629 0 C-N-CA 122.589 2.193 . . . . 0.0 112.292 178.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.421 ' CG2' ' N ' ' A' ' 50' ' ' THR . 5.0 m -64.57 -39.73 86.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.815 0.817 . . . . 0.0 110.695 179.193 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.421 ' N ' ' CG2' ' A' ' 49' ' ' VAL . 8.5 m -56.34 -66.08 0.5 Allowed 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 114.738 -1.119 . . . . 0.0 110.548 179.316 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -50.43 -39.24 46.97 Favored 'General case' 0 C--O 1.24 0.559 0 CA-C-O 121.441 0.639 . . . . 0.0 109.645 -179.204 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.4 tt -59.55 -42.17 91.77 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.859 -0.61 . . . . 0.0 109.433 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.533 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -65.0 -42.87 94.11 Favored 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 120.863 -0.335 . . . . 0.0 110.135 179.591 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 83.6 tt0 -53.62 -34.23 57.79 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 179.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -72.13 -38.87 69.17 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.582 178.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 96.8 mt -88.41 -68.95 0.62 Allowed 'Isoleucine or valine' 0 CA--C 1.521 -0.173 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.244 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . 0.533 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 148.94 71.25 0.01 OUTLIER Glycine 0 CA--C 1.521 0.451 0 N-CA-C 111.682 -0.567 . . . . 0.0 111.682 179.617 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 4.1 mmt 57.83 79.15 0.21 Allowed 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 120.779 0.323 . . . . 0.0 110.641 179.35 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 86.4 mt-10 -150.91 19.93 0.78 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.729 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -61.77 -30.64 70.93 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.411 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 36.0 t -65.26 -42.94 92.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.524 -179.8 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.53 -30.88 71.62 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.082 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 89.8 t -70.49 -49.91 49.39 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.209 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.566 179.436 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 38.8 t -57.06 -42.56 80.79 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 120.892 0.377 . . . . 0.0 110.249 -179.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 43.5 t60 -60.91 -50.6 72.76 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-O 121.259 0.552 . . . . 0.0 110.499 179.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 37.0 mt-30 -62.32 -34.54 76.82 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.069 179.646 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 2.4 tp -62.91 -43.68 98.14 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.223 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 95.5 mtt-85 -62.57 -41.56 99.0 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 120.849 0.356 . . . . 0.0 110.186 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 86.2 t -63.1 -53.84 41.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.199 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 12.5 mt -61.13 -40.85 95.35 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.027 0.441 . . . . 0.0 110.048 -179.485 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 62.2 ttm-85 -54.83 -41.01 70.16 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.941 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 -60.14 -48.18 82.81 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 120.396 -0.522 . . . . 0.0 110.495 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.4 mt -66.87 -41.47 87.21 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.936 0.398 . . . . 0.0 110.555 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 100.41 88.99 2.02 Favored Glycine 0 CA--C 1.52 0.389 0 N-CA-C 110.947 -0.861 . . . . 0.0 110.947 -179.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 5.1 tp -152.2 -14.17 0.18 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.749 0.309 . . . . 0.0 110.853 179.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.412 ' HA ' ' H ' ' A' ' 90' ' ' TYR . 28.1 m -134.96 158.64 41.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.066 -179.701 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.509 ' CG1' ' N ' ' A' ' 78' ' ' GLY . 59.4 t -124.07 170.98 13.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.276 -179.635 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . 0.509 ' N ' ' CG1' ' A' ' 77' ' ' VAL . . . -158.53 149.13 19.17 Favored Glycine 0 CA--C 1.526 0.733 0 N-CA-C 110.604 -0.998 . . . . 0.0 110.604 179.386 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 62.7 t0 -124.7 123.46 40.07 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 120.905 0.383 . . . . 0.0 110.447 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 94.9 mtt-85 -73.79 153.47 39.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.54 -179.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -165.38 97.43 0.69 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.636 -179.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 64.11 -124.15 29.55 Favored Glycine 0 CA--C 1.524 0.624 0 N-CA-C 110.831 -0.908 . . . . 0.0 110.831 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 34.9 ptt180 -96.79 13.13 29.61 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.47 0.176 . . . . 0.0 110.797 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 24.7 m -141.68 163.8 31.93 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-O 121.084 0.468 . . . . 0.0 109.903 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.523 ' CD1' ' CE2' ' A' ' 87' ' ' TYR . 0.8 OUTLIER -141.94 162.81 19.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.225 179.907 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 52.2 t -113.19 138.42 42.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 179.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.583 ' N ' ' CD1' ' A' ' 87' ' ' TYR . 0.2 OUTLIER -112.25 136.06 52.15 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.063 -179.815 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 1.9 m -150.92 171.66 16.9 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.805 -0.442 . . . . 0.0 109.805 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 34.0 mt -84.28 143.31 29.63 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.616 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.412 ' H ' ' HA ' ' A' ' 76' ' ' VAL . 77.5 t80 -60.42 -45.67 92.79 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.689 179.665 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.4 ' CB ' ' HD1' ' A' ' 93' ' ' HIS . 35.7 p30 -141.98 171.5 13.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.507 -179.893 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 54.9 p -96.83 -7.23 34.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.564 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . 0.606 ' CG ' ' CE1' ' B' ' 223' ' ' HIS . 61.4 m80 -41.85 -61.45 1.11 Allowed 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.033 0.444 . . . . 0.0 110.637 179.734 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 69.1 t -53.88 -41.04 47.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.788 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -56.84 -43.51 81.17 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.346 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 90.6 mt-30 -62.27 -45.4 93.46 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 121.153 0.502 . . . . 0.0 110.132 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 13.6 tp -56.84 -44.38 82.04 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.007 -179.332 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 92.9 mt -64.13 -37.12 86.3 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.01 179.546 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 46.3 t0 -56.47 -45.62 80.8 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.107 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.463 ' OE2' ' OE2' ' B' ' 219' ' ' GLU . 91.7 mt-10 -67.52 -52.09 43.16 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.604 179.382 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -52.74 -46.39 67.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.057 179.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 5.2 mm -63.39 -44.25 98.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 121.132 0.491 . . . . 0.0 110.71 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -60.65 -46.19 91.26 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.254 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . 0.61 ' CE1' ' CG ' ' B' ' 212' ' ' HIS . 68.2 t60 -65.29 -36.81 85.21 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.465 179.733 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 47.2 t -59.48 -46.59 88.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.333 -179.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 77.9 tt0 -74.7 -60.55 2.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.075 0.464 . . . . 0.0 110.807 179.333 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 85.6 t60 -50.14 -28.62 7.65 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.913 -179.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.42 ' CB ' ' O ' ' A' ' 104' ' ' HIS . 0.2 OUTLIER -110.83 89.11 2.95 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.489 179.748 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 49.7 t-80 -152.55 14.42 0.57 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.708 179.522 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 88.4 mt -62.67 -43.0 99.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.606 -179.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 70.87 -177.01 35.49 Favored Glycine 0 CA--C 1.523 0.567 0 N-CA-C 110.692 -0.963 . . . . 0.0 110.692 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -144.12 73.27 1.38 Allowed 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 110.218 -0.29 . . . . 0.0 110.218 179.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.477 ' O ' ' O ' ' A' ' 114' ' ' ASP . 83.1 p 39.89 -153.18 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.514 179.771 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . 0.477 ' O ' ' O ' ' A' ' 113' ' ' SER . 98.5 m-20 57.38 137.2 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.057 0.456 . . . . 0.0 110.725 179.847 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 6.7 ptp180 -141.23 150.33 42.52 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.57 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . 0.449 ' CG ' ' O ' ' A' ' 116' ' ' HIS . 5.3 p80 -167.37 72.9 1.0 Allowed Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.407 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -52.58 -38.85 76.2 Favored 'Trans proline' 0 C--N 1.307 -1.653 0 C-N-CA 122.828 2.352 . . . . 0.0 112.106 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 64.8 m -130.71 152.47 50.03 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.544 -179.629 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -63.75 -37.96 89.32 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.497 -179.795 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.693 0 CA-C-O 118.068 -1.407 . . . . 0.0 110.938 -179.962 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.321 0 N-CA-C 109.526 -1.429 . . . . 0.0 109.526 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 98.8 m-70 -97.76 126.15 42.96 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.8 0.333 . . . . 0.0 110.451 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 123' ' ' GLY . . . . . . . . . . . . . . . -86.27 94.29 1.93 Allowed Glycine 0 CA--C 1.524 0.629 0 N-CA-C 110.979 -0.849 . . . . 0.0 110.979 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 16.6 m -75.59 -21.89 16.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.004 0.43 . . . . 0.0 110.683 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 125' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -69.54 150.2 47.39 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.614 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -152.16 -103.91 0.25 Allowed Glycine 0 CA--C 1.524 0.616 0 N-CA-C 110.873 -0.891 . . . . 0.0 110.873 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 127' ' ' ARG . . . . . . . . . . . . . 41.8 ttm180 47.29 87.55 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.648 0.261 . . . . 0.0 110.45 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 128' ' ' ASN . . . . . 0.543 ' CG ' ' H ' ' B' ' 129' ' ' ARG . 60.1 t30 -139.0 -146.07 0.2 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.32 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 129' ' ' ARG . . . . . 0.543 ' H ' ' CG ' ' B' ' 128' ' ' ASN . 69.0 mtm180 56.56 59.42 8.37 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.532 -179.76 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -72.49 148.86 48.89 Favored 'Trans proline' 0 C--N 1.311 -1.44 0 C-N-CA 122.757 2.305 . . . . 0.0 112.136 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 42.6 t -163.09 126.12 2.73 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.233 179.632 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 132' ' ' ALA . . . . . 0.57 ' N ' ' CD ' ' B' ' 133' ' ' PRO . . . 172.86 -44.71 0.0 OUTLIER Pre-proline 0 CA--C 1.534 0.34 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.436 -179.477 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 133' ' ' PRO . . . . . 0.57 ' CD ' ' N ' ' B' ' 132' ' ' ALA . 51.5 Cg_exo -54.08 -162.98 0.01 OUTLIER 'Trans proline' 0 C--N 1.313 -1.296 0 C-N-CA 122.549 2.166 . . . . 0.0 112.04 -178.812 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . 0.53 ' O ' ' N ' ' B' ' 136' ' ' SER . 63.5 mt -66.01 153.56 41.85 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.218 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 135' ' ' ASP . . . . . 0.52 ' O ' ' N ' ' B' ' 138' ' ' ALA . 97.9 m-20 -43.08 -17.11 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.631 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 136' ' ' SER . . . . . 0.53 ' N ' ' O ' ' B' ' 134' ' ' LEU . 92.8 p -38.43 -40.08 0.52 Allowed 'General case' 0 C--O 1.236 0.352 0 CA-C-O 121.27 0.557 . . . . 0.0 110.403 -179.71 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 137' ' ' GLN . . . . . 0.416 ' N ' ' HG ' ' B' ' 136' ' ' SER . 95.9 mm-40 -65.66 -43.27 89.91 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.172 179.175 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 138' ' ' ALA . . . . . 0.52 ' N ' ' O ' ' B' ' 135' ' ' ASP . . . -64.81 -29.1 70.05 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.489 179.44 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.83 -52.43 30.02 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.338 179.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -60.47 -50.14 74.76 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.929 0.395 . . . . 0.0 111.172 179.592 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 68.1 tp60 -53.92 -49.55 68.4 Favored 'General case' 0 C--O 1.243 0.72 0 CA-C-O 121.591 0.71 . . . . 0.0 110.019 -179.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 142' ' ' VAL . . . . . . . . . . . . . 53.4 t -62.21 -42.71 96.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.784 179.38 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -50.24 -46.76 55.07 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.011 179.648 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 11.3 t -59.99 -44.51 94.48 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.155 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 19.8 m -63.75 -51.36 65.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.265 0.555 . . . . 0.0 111.049 179.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 92.5 mt -67.75 -21.1 65.29 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.909 -179.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 147' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -75.34 -59.37 2.77 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.728 179.417 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 148' ' ' ALA . . . . . 0.47 ' O ' ' OG1' ' B' ' 151' ' ' THR . . . -59.02 -53.69 55.56 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.049 -179.159 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.441 ' O ' ' C ' ' B' ' 150' ' ' ALA . 4.0 mm? -50.86 -41.95 58.37 Favored 'General case' 0 CA--C 1.509 -0.599 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 -178.304 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 150' ' ' ALA . . . . . 0.553 ' O ' ' C ' ' B' ' 151' ' ' THR . . . -38.91 -72.18 0.07 Allowed 'General case' 0 CA--C 1.511 -0.555 0 O-C-N 123.519 0.512 . . . . 0.0 110.334 179.719 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 151' ' ' THR . . . . . 0.553 ' C ' ' O ' ' B' ' 150' ' ' ALA . 6.5 p -1.77 105.74 0.02 OUTLIER Pre-proline 0 N--CA 1.478 0.948 0 O-C-N 124.428 1.08 . . . . 0.0 111.088 -179.839 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo -46.32 -48.73 12.77 Favored 'Trans proline' 0 C--N 1.307 -1.648 0 C-N-CA 122.053 1.836 . . . . 0.0 113.154 -177.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 11.3 t -57.2 -43.99 83.22 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.722 -179.214 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 38.7 ttm180 -62.42 -43.86 97.82 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.592 -179.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 155' ' ' LEU . . . . . . . . . . . . . 31.5 mt -58.4 -51.5 69.57 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.424 -0.511 . . . . 0.0 110.718 -179.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 156' ' ' MET . . . . . 0.43 ' O ' ' OG1' ' B' ' 159' ' ' THR . 51.9 ttp -55.44 -45.65 76.81 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 120.267 -0.573 . . . . 0.0 110.596 179.727 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 97.0 mt -62.65 -47.4 93.08 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 CA-C-O 121.378 0.609 . . . . 0.0 110.87 -179.514 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -62.53 -41.31 98.79 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.602 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 159' ' ' THR . . . . . 0.43 ' OG1' ' O ' ' B' ' 156' ' ' MET . 31.3 p -62.47 -32.77 73.71 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.064 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 59.2 tp60 -64.93 -50.17 67.51 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.223 -0.444 . . . . 0.0 109.949 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 161' ' ' LEU . . . . . 0.429 ' O ' ' N ' ' B' ' 164' ' ' GLY . 17.0 mt -62.49 -31.75 72.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.584 179.776 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 162' ' ' ARG . . . . . . . . . . . . . 11.2 ttm180 -40.82 -41.47 1.58 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.618 -179.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -62.33 -42.25 99.23 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.316 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 164' ' ' GLY . . . . . 0.429 ' N ' ' O ' ' B' ' 161' ' ' LEU . . . 161.03 178.58 35.13 Favored Glycine 0 CA--C 1.527 0.785 0 C-N-CA 120.672 -0.775 . . . . 0.0 111.331 179.086 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_exo -67.74 147.94 76.44 Favored 'Trans proline' 0 N--CA 1.49 1.272 0 C-N-CA 122.836 2.357 . . . . 0.0 112.028 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -163.76 160.61 17.36 Favored Pre-proline 0 CA--C 1.534 0.359 0 C-N-CA 120.133 -0.627 . . . . 0.0 110.701 178.717 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 16.1 Cg_exo -68.22 149.33 75.98 Favored 'Trans proline' 0 N--CA 1.495 1.583 0 C-N-CA 122.525 2.15 . . . . 0.0 112.119 178.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 168' ' ' VAL . . . . . 0.426 ' CG2' ' N ' ' B' ' 169' ' ' THR . 4.5 m -64.54 -40.0 87.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 121.819 0.818 . . . . 0.0 110.728 179.143 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 169' ' ' THR . . . . . 0.426 ' N ' ' CG2' ' B' ' 168' ' ' VAL . 7.0 m -55.87 -66.5 0.41 Allowed 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 114.702 -1.135 . . . . 0.0 110.496 179.381 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 93.2 m-20 -50.35 -39.91 47.65 Favored 'General case' 0 C--O 1.239 0.546 0 CA-C-O 121.326 0.584 . . . . 0.0 109.687 -179.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 1.5 tt -58.99 -42.5 90.18 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.379 -0.601 . . . . 0.0 109.379 -179.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 172' ' ' ALA . . . . . 0.539 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -64.37 -42.63 96.08 Favored 'General case' 0 N--CA 1.446 -0.675 0 C-N-CA 120.826 -0.35 . . . . 0.0 110.18 179.575 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -53.92 -34.51 59.78 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.099 -0.5 . . . . 0.0 109.695 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -71.97 -38.22 69.77 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.574 178.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 96.7 mt -88.55 -69.43 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.519 -0.246 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.296 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 176' ' ' GLY . . . . . 0.539 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 148.98 70.43 0.01 OUTLIER Glycine 0 CA--C 1.522 0.5 0 N-CA-C 111.518 -0.633 . . . . 0.0 111.518 179.654 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 3.9 mmt 58.71 78.46 0.25 Allowed 'General case' 0 N--CA 1.462 0.148 0 CA-C-O 120.782 0.325 . . . . 0.0 110.807 179.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 86.3 mt-10 -150.55 20.15 0.82 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.8 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -61.69 -29.96 70.43 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.056 0.455 . . . . 0.0 110.29 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 6.9 t -65.57 -43.38 89.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.529 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -62.31 -30.81 71.41 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.177 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 83.9 t -71.0 -50.36 43.17 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.185 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.591 179.497 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 42.9 t -57.37 -41.74 80.74 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.928 0.394 . . . . 0.0 110.336 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 19.5 t60 -61.64 -51.0 70.27 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.212 0.53 . . . . 0.0 110.51 179.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 36.4 mt-30 -62.65 -32.81 73.92 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.015 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 2.7 tp -63.27 -44.12 96.02 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.1 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -62.63 -41.88 99.28 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 120.729 -0.388 . . . . 0.0 110.31 -179.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 98.1 t -62.58 -54.13 38.0 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 C-N-CA 119.974 -0.69 . . . . 0.0 110.351 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 12.6 mt -60.73 -40.35 92.01 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.08 0.466 . . . . 0.0 110.049 -179.479 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 62.7 ttm-85 -55.15 -41.68 72.12 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.025 -179.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 92.1 m-20 -59.69 -46.82 87.92 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.439 -0.504 . . . . 0.0 110.281 -179.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 192' ' ' LEU . . . . . . . . . . . . . 9.7 mt -67.11 -39.75 86.74 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.953 0.406 . . . . 0.0 110.417 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 97.54 88.79 1.88 Allowed Glycine 0 N--CA 1.463 0.474 0 N-CA-C 110.765 -0.934 . . . . 0.0 110.765 -179.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 4.7 tp -152.45 -13.64 0.17 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.802 0.334 . . . . 0.0 110.859 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 195' ' ' VAL . . . . . 0.411 ' HA ' ' H ' ' B' ' 209' ' ' TYR . 27.7 m -135.02 158.64 41.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 109.832 -0.432 . . . . 0.0 109.832 -179.697 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 196' ' ' VAL . . . . . 0.509 ' CG1' ' N ' ' B' ' 197' ' ' GLY . 64.7 t -121.8 169.02 13.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.323 -179.688 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 197' ' ' GLY . . . . . 0.509 ' N ' ' CG1' ' B' ' 196' ' ' VAL . . . -157.33 142.04 8.31 Favored Glycine 0 CA--C 1.525 0.665 0 N-CA-C 110.615 -0.994 . . . . 0.0 110.615 179.471 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 60.4 t0 -119.63 125.26 48.3 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 120.935 0.398 . . . . 0.0 110.559 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 94.1 mtt-85 -75.03 152.56 38.68 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.572 -179.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 200' ' ' ALA . . . . . . . . . . . . . . . -164.69 99.32 0.79 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.523 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 201' ' ' GLY . . . . . . . . . . . . . . . 60.82 -125.31 37.95 Favored Glycine 0 CA--C 1.522 0.506 0 N-CA-C 110.752 -0.939 . . . . 0.0 110.752 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 202' ' ' ARG . . . . . . . . . . . . . 35.1 ptt180 -96.68 21.05 9.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.546 0.212 . . . . 0.0 110.667 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 30.9 m -150.18 162.98 39.39 Favored 'General case' 0 CA--C 1.517 -0.299 0 N-CA-C 109.722 -0.474 . . . . 0.0 109.722 -179.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 204' ' ' ILE . . . . . 0.534 ' CD1' ' CE2' ' B' ' 206' ' ' TYR . 0.8 OUTLIER -141.72 162.24 20.64 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.187 -179.967 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 55.6 t -112.79 134.79 54.26 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 179.546 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 206' ' ' TYR . . . . . 0.593 ' N ' ' CD1' ' B' ' 206' ' ' TYR . 0.2 OUTLIER -108.43 135.9 48.94 Favored 'General case' 0 N--CA 1.469 0.485 0 O-C-N 123.58 0.55 . . . . 0.0 109.987 -179.834 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 207' ' ' SER . . . . . 0.42 ' HG ' ' C ' ' B' ' 206' ' ' TYR . 3.1 m -150.63 171.16 17.57 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 -179.834 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . 29.5 mt -83.77 143.13 30.19 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.623 -179.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 209' ' ' TYR . . . . . 0.411 ' H ' ' HA ' ' B' ' 195' ' ' VAL . 81.0 t80 -60.69 -46.02 91.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.71 179.77 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 43.2 p30 -140.84 172.56 12.52 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.338 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 43.5 p -98.37 -7.65 28.42 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.439 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 212' ' ' HIS . . . . . 0.61 ' CG ' ' CE1' ' A' ' 104' ' ' HIS . 60.5 m80 -41.7 -61.33 1.11 Allowed 'General case' 0 C--O 1.233 0.224 0 CA-C-O 120.96 0.41 . . . . 0.0 110.419 179.779 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 92.0 t -53.88 -41.64 49.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.181 -0.463 . . . . 0.0 109.771 -179.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 214' ' ' ALA . . . . . . . . . . . . . . . -56.44 -43.37 79.43 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.368 179.814 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 84.3 mt-30 -62.38 -45.26 93.97 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.072 -179.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 216' ' ' LEU . . . . . . . . . . . . . 12.6 tp -56.61 -44.38 81.1 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.509 -0.477 . . . . 0.0 109.898 -179.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 92.5 mt -63.8 -38.23 90.32 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.093 179.522 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 58.0 t0 -56.05 -45.84 79.09 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.08 -179.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 219' ' ' GLU . . . . . 0.463 ' OE2' ' OE2' ' A' ' 100' ' ' GLU . 93.6 mt-10 -67.66 -51.79 45.67 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.708 -0.397 . . . . 0.0 110.62 179.462 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -53.09 -46.32 68.59 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 179.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 4.8 mm -63.73 -44.08 98.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 121.084 0.469 . . . . 0.0 110.613 -179.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 84.5 t80 -60.58 -45.76 92.76 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.017 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 223' ' ' HIS . . . . . 0.606 ' CE1' ' CG ' ' A' ' 93' ' ' HIS . 68.5 t60 -65.55 -37.01 85.47 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.534 179.641 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 11.5 t -59.12 -46.73 87.58 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.339 -179.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -74.58 -59.8 2.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.09 0.472 . . . . 0.0 110.663 179.348 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 86.1 t60 -50.51 -30.31 12.62 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.877 -179.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 227' ' ' LEU . . . . . 0.426 ' CB ' ' O ' ' B' ' 223' ' ' HIS . 0.2 OUTLIER -108.94 87.77 2.57 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.564 179.76 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 228' ' ' HIS . . . . . 0.495 ' ND1' ' O ' ' B' ' 228' ' ' HIS . 56.3 t-80 -151.66 15.66 0.68 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.687 179.538 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 229' ' ' LEU . . . . . . . . . . . . . 84.9 mt -63.47 -43.39 97.46 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.836 -179.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . 71.44 -177.23 37.09 Favored Glycine 0 CA--C 1.525 0.696 0 N-CA-C 110.664 -0.975 . . . . 0.0 110.664 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 231' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -144.8 72.34 1.33 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.713 0.292 . . . . 0.0 110.311 -179.882 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 232' ' ' SER . . . . . 0.482 ' O ' ' O ' ' B' ' 233' ' ' ASP . 85.8 p 40.63 -153.19 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.597 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 233' ' ' ASP . . . . . 0.482 ' O ' ' O ' ' B' ' 232' ' ' SER . 97.8 m-20 57.26 138.37 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.182 0.515 . . . . 0.0 110.708 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 234' ' ' ARG . . . . . . . . . . . . . 7.1 ptp180 -142.23 151.24 41.91 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.565 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 235' ' ' HIS . . . . . 0.427 ' O ' ' CG ' ' B' ' 235' ' ' HIS . 4.9 p80 -168.74 73.66 0.79 Allowed Pre-proline 0 C--N 1.328 -0.349 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.474 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 236' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -53.47 -38.7 83.41 Favored 'Trans proline' 0 C--N 1.308 -1.571 0 C-N-CA 122.821 2.347 . . . . 0.0 112.103 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 237' ' ' SER . . . . . . . . . . . . . 73.2 m -129.68 152.79 48.8 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.468 -179.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 238' ' ' ALA . . . . . . . . . . . . . . . -63.48 -36.16 82.85 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.452 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.219 -0.827 0 CA-C-O 118.023 -1.432 . . . . 0.0 110.978 179.973 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.23 0 N-CA-C 109.596 -1.402 . . . . 0.0 109.596 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 99.1 m-70 45.97 79.49 0.05 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.794 0.33 . . . . 0.0 110.636 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -62.47 -42.02 99.73 Favored Glycine 0 CA--C 1.522 0.491 0 N-CA-C 110.855 -0.898 . . . . 0.0 110.855 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 35.6 m -137.96 160.56 33.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.872 0.368 . . . . 0.0 110.442 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -138.38 144.76 40.4 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.62 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 78.63 0.48 80.11 Favored Glycine 0 CA--C 1.52 0.352 0 N-CA-C 110.968 -0.853 . . . . 0.0 110.968 179.767 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 14.4 tpt180 -145.1 120.07 10.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.798 0.332 . . . . 0.0 110.571 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -153.82 126.04 7.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.689 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 67.1 ttt180 54.07 68.87 2.46 Favored Pre-proline 0 C--N 1.326 -0.421 0 CA-C-O 121.153 0.502 . . . . 0.0 110.643 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.426 ' O ' ' O ' ' A' ' 12' ' ' SER . 22.2 Cg_exo -63.83 146.86 92.24 Favored 'Trans proline' 0 C--N 1.306 -1.707 0 C-N-CA 122.854 2.369 . . . . 0.0 112.098 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.426 ' O ' ' O ' ' A' ' 11' ' ' PRO . 46.1 m 45.68 97.3 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.689 179.154 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.471 ' N ' ' HD2' ' A' ' 14' ' ' PRO . . . -175.65 -61.9 0.0 OUTLIER Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.201 -179.495 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.471 ' HD2' ' N ' ' A' ' 13' ' ' ALA . 25.1 Cg_endo -60.68 -31.3 91.88 Favored 'Trans proline' 0 C--N 1.31 -1.474 0 C-N-CA 122.619 2.213 . . . . 0.0 111.908 -179.757 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.563 ' O ' ' N ' ' A' ' 17' ' ' SER . 59.2 mt -106.58 86.0 2.26 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.25 -179.55 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 95.4 m-20 -37.17 -24.28 0.01 OUTLIER 'General case' 0 CA--C 1.528 0.111 0 O-C-N 123.45 0.469 . . . . 0.0 110.737 179.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.563 ' N ' ' O ' ' A' ' 15' ' ' LEU . 12.4 t -45.02 -48.17 11.6 Favored 'General case' 0 C--O 1.239 0.549 0 CA-C-O 121.164 0.507 . . . . 0.0 110.142 179.488 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 9.4 mp0 -64.53 -45.53 86.75 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.125 -0.488 . . . . 0.0 109.895 179.461 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -56.14 -28.4 57.85 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.189 -0.46 . . . . 0.0 109.872 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -71.98 -49.54 36.4 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 110.108 -0.33 . . . . 0.0 110.108 179.429 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.03 -44.96 96.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.354 -179.803 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -60.96 -51.62 68.5 Favored 'General case' 0 C--O 1.242 0.671 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.701 -179.507 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.494 ' O ' ' OG1' ' A' ' 26' ' ' THR . 98.8 t -60.49 -44.28 96.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.967 179.744 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.69 -42.14 78.56 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 120.804 -0.358 . . . . 0.0 110.201 179.525 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.2 m -59.2 -43.86 92.23 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.309 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.494 ' OG1' ' O ' ' A' ' 23' ' ' VAL . 30.6 p -64.83 -52.24 57.78 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 120.833 -0.347 . . . . 0.0 110.635 179.872 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.414 ' N ' ' CD1' ' A' ' 27' ' ' LEU . 7.6 mp -63.17 -21.58 66.3 Favored 'General case' 0 C--O 1.223 -0.295 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.787 179.493 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -74.31 -59.91 2.51 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.688 179.391 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.62 -54.63 44.88 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.518 -179.478 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.505 ' O ' ' O ' ' A' ' 31' ' ' ALA . 8.5 mp -47.79 -32.42 5.99 Favored 'General case' 0 CA--C 1.515 -0.393 0 C-N-CA 120.956 -0.298 . . . . 0.0 110.387 -179.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.505 ' O ' ' O ' ' A' ' 30' ' ' LEU . . . -56.84 -139.04 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.459 0 O-C-N 123.51 0.506 . . . . 0.0 110.247 179.711 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.485 ' O ' ' O ' ' A' ' 31' ' ' ALA . 7.1 m 56.54 117.35 0.01 OUTLIER Pre-proline 0 C--N 1.32 -0.695 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.347 179.659 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -48.37 -47.83 18.89 Favored 'Trans proline' 0 C--N 1.308 -1.561 0 C-N-CA 122.311 2.008 . . . . 0.0 112.824 -178.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 77.8 p -58.15 -48.71 79.42 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.977 -178.467 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.1 mmp_? -68.15 -36.58 79.9 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.584 179.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.34 -53.45 56.55 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.468 -0.493 . . . . 0.0 110.687 -178.367 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.453 ' C ' ' SD ' ' A' ' 37' ' ' MET . 0.9 OUTLIER -60.73 -45.77 93.0 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.473 179.967 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 86.8 mt -61.18 -43.56 96.62 Favored 'Isoleucine or valine' 0 C--O 1.242 0.66 0 CA-C-O 121.258 0.552 . . . . 0.0 110.394 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 34.5 mt -62.06 -40.59 96.29 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.519 179.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 99.0 m -59.92 -42.25 93.53 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.912 179.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.451 ' NE2' ' SD ' ' A' ' 37' ' ' MET . 45.7 mt-30 -58.23 -44.12 88.08 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.132 179.715 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 19.4 mt -63.79 -42.92 97.65 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.897 178.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.507 HH12 ' C ' ' A' ' 98' ' ' LEU . 59.0 ttp180 -62.69 -35.88 81.12 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.323 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 14.3 t-20 -57.82 -41.42 82.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.607 -178.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 163.36 -175.96 39.58 Favored Glycine 0 CA--C 1.526 0.762 0 N-CA-C 110.972 -0.851 . . . . 0.0 110.972 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -74.58 135.03 19.35 Favored 'Trans proline' 0 N--CA 1.495 1.603 0 C-N-CA 122.812 2.341 . . . . 0.0 112.075 -179.533 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -157.02 98.82 2.01 Favored Pre-proline 0 CA--C 1.54 0.585 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.265 -178.833 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_exo -47.12 165.05 0.1 Allowed 'Trans proline' 0 C--N 1.301 -1.934 0 C-N-CA 122.321 2.014 . . . . 0.0 112.554 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 75.1 t -48.6 -43.48 13.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.693 -179.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 47.3 p -61.25 -39.86 91.91 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.504 179.569 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -64.71 -38.2 90.2 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.003 179.769 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.5 -46.84 86.62 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 120.42 -0.512 . . . . 0.0 110.223 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.525 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -55.18 -47.2 75.56 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.657 179.558 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 48.9 tp10 -55.38 -50.41 69.78 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.168 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.08 -58.22 7.21 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.767 -179.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 98.4 mt -85.7 -73.69 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.444 179.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . 0.525 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 131.62 94.51 0.63 Allowed Glycine 0 N--CA 1.461 0.358 0 N-CA-C 111.163 -0.775 . . . . 0.0 111.163 179.695 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 84.6 mmm 67.54 84.27 0.16 Allowed 'General case' 0 CA--C 1.521 -0.161 0 CA-C-O 120.829 0.347 . . . . 0.0 111.025 178.593 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 15.2 tt0 -169.32 28.15 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.275 179.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -66.45 -23.83 66.34 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.78 -179.335 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 15.5 t -66.06 -44.46 84.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.132 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.531 ' O ' ' NE2' ' A' ' 66' ' ' GLN . . . -63.4 -31.98 73.28 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.327 -179.695 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 60.2 t -72.6 -53.81 18.04 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.242 0 C-N-CA 120.746 -0.382 . . . . 0.0 110.647 -179.457 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 79.7 p -58.13 -40.3 80.94 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.909 -0.317 . . . . 0.0 110.165 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . 0.41 ' ND1' ' OE1' ' A' ' 66' ' ' GLN . 50.4 t-80 -65.86 -51.21 60.74 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.087 0.47 . . . . 0.0 110.845 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.531 ' NE2' ' O ' ' A' ' 62' ' ' ALA . 0.7 OUTLIER -61.9 -39.55 92.35 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.287 179.765 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 23.6 tp -61.8 -44.3 97.14 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.236 -179.49 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 21.0 mmt85 -61.67 -41.64 97.83 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 120.795 0.331 . . . . 0.0 110.516 -179.376 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 94.0 t -61.2 -55.01 27.48 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.222 0 C-N-CA 120.224 -0.59 . . . . 0.0 110.262 -179.522 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 10.5 mp -62.0 -39.57 92.68 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 179.392 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 78.1 ttt-85 -51.96 -42.67 63.07 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.003 -179.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -60.63 -45.57 93.54 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.638 -0.425 . . . . 0.0 110.25 179.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.8 mt -65.84 -38.71 89.59 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.134 179.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 91.33 32.75 8.53 Favored Glycine 0 CA--C 1.522 0.522 0 N-CA-C 110.905 -0.878 . . . . 0.0 110.905 -179.534 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 91.2 mt -95.85 -1.33 49.71 Favored 'General case' 0 CA--C 1.519 -0.232 0 O-C-N 122.86 -0.2 . . . . 0.0 110.597 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 26.8 m -134.28 155.97 39.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.191 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 73.0 t -124.95 137.61 56.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.146 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -119.89 129.87 8.17 Favored Glycine 0 N--CA 1.465 0.589 0 N-CA-C 110.734 -0.946 . . . . 0.0 110.734 179.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -107.62 99.07 8.59 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 110.304 -0.258 . . . . 0.0 110.304 -179.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 73.0 ttt180 -85.29 125.96 33.33 Favored 'General case' 0 CA--C 1.519 -0.219 0 O-C-N 123.476 0.485 . . . . 0.0 110.413 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.436 ' O ' ' OG ' ' A' ' 84' ' ' SER . . . -173.15 144.13 1.19 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.712 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.496 ' O ' ' N ' ' A' ' 84' ' ' SER . . . 44.58 69.02 0.79 Allowed Glycine 0 C--N 1.329 0.19 0 N-CA-C 110.741 -0.944 . . . . 0.0 110.741 179.659 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.439 ' C ' ' O ' ' A' ' 82' ' ' GLY . 14.8 ptp180 32.76 34.09 0.01 OUTLIER 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.892 0.377 . . . . 0.0 110.857 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' SER . . . . . 0.496 ' N ' ' O ' ' A' ' 82' ' ' GLY . 54.7 p -144.02 122.69 12.56 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.18 -179.197 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 1.9 tp -114.87 124.88 71.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.11 179.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 99.5 t -101.14 121.36 51.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.577 178.506 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 65.4 m-85 -98.62 125.2 43.81 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.133 179.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 86.7 p -142.24 160.62 39.89 Favored 'General case' 0 C--O 1.224 -0.271 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.438 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 7.3 mt -72.73 136.69 45.57 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.633 -179.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.468 ' CD1' ' C ' ' A' ' 90' ' ' TYR . 20.8 t80 -62.59 -51.52 67.0 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.743 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.5 m-20 -83.58 143.06 30.4 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.526 -179.409 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 98.9 m -94.21 -25.82 16.92 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.357 179.091 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . 0.62 ' CG ' ' ND1' ' B' ' 223' ' ' HIS . 77.9 m-70 -58.23 -44.04 88.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.363 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.403 ' CG2' ' N ' ' A' ' 95' ' ' ALA . 20.0 m -56.04 -42.01 70.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.021 -179.862 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . 0.403 ' N ' ' CG2' ' A' ' 94' ' ' VAL . . . -60.88 -45.97 92.46 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.997 0.427 . . . . 0.0 110.28 179.035 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 67.1 tp60 -62.04 -41.52 98.21 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.106 179.34 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 11.3 tp -58.56 -44.4 89.7 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.22 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.507 ' C ' HH12 ' A' ' 43' ' ' ARG . 87.1 mt -63.24 -39.54 94.91 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.227 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . 0.494 ' N ' ' NH1' ' A' ' 43' ' ' ARG . 52.1 m-20 -59.36 -41.24 88.82 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.747 0.308 . . . . 0.0 110.527 -179.481 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -69.53 -54.41 14.28 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.993 179.456 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.12 -43.23 91.94 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.443 -179.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . 0.401 ' CG1' ' O ' ' A' ' 98' ' ' LEU . 4.1 mm -61.68 -45.54 98.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.328 -179.283 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 87.7 t80 -60.2 -39.7 87.47 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.865 0.365 . . . . 0.0 110.275 179.594 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . 0.574 ' ND1' ' CG ' ' B' ' 212' ' ' HIS . 57.6 t60 -63.76 -39.34 94.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.747 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 29.8 t -75.7 -42.8 49.91 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.895 179.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 11.6 tm-20 -60.08 -37.86 81.17 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.495 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . 0.629 ' O ' ' N ' ' A' ' 109' ' ' HIS . 82.2 t60 -50.56 -70.13 0.09 Allowed 'General case' 0 CA--C 1.508 -0.647 0 CA-C-N 116.114 -0.493 . . . . 0.0 109.887 -179.048 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.541 ' C ' ' H ' ' A' ' 110' ' ' LEU . 1.0 OUTLIER 32.02 -83.82 0.0 OUTLIER 'General case' 0 CA--C 1.515 -0.4 0 O-C-N 123.32 0.388 . . . . 0.0 111.41 179.947 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . 0.629 ' N ' ' O ' ' A' ' 107' ' ' HIS . 37.4 m80 64.65 -45.2 0.32 Allowed 'General case' 0 C--N 1.332 -0.155 0 O-C-N 124.423 1.077 . . . . 0.0 110.188 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.541 ' H ' ' C ' ' A' ' 108' ' ' LEU . 82.6 mt -63.72 -42.15 97.96 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.766 179.709 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 75.95 77.7 0.72 Allowed Glycine 0 CA--C 1.525 0.669 0 N-CA-C 111.16 -0.776 . . . . 0.0 111.16 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.549 ' N ' ' CD2' ' A' ' 112' ' ' LEU . 3.5 mm? -76.51 142.39 40.91 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.828 0.347 . . . . 0.0 110.721 -179.738 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 4.0 m -50.82 87.7 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.42 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . 0.511 ' N ' ' O ' ' A' ' 112' ' ' LEU . 96.6 m-20 -88.3 151.42 22.64 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.492 179.835 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 23.6 ptt180 -71.24 171.36 11.22 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.393 179.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . 0.404 ' O ' ' CG ' ' A' ' 116' ' ' HIS . 82.1 t60 -133.55 66.06 73.05 Favored Pre-proline 0 N--CA 1.465 0.279 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.476 -179.822 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -76.29 155.26 37.0 Favored 'Trans proline' 0 C--N 1.307 -1.644 0 C-N-CA 122.813 2.342 . . . . 0.0 112.028 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' SER . . . . . 0.429 ' O ' ' O ' ' A' ' 119' ' ' ALA . 35.5 t -151.59 88.04 1.4 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.512 179.468 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . 0.429 ' O ' ' O ' ' A' ' 118' ' ' SER . . . 40.61 -163.29 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.751 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.676 0 CA-C-O 117.931 -1.483 . . . . 0.0 110.872 179.862 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.305 0 N-CA-C 109.488 -1.445 . . . . 0.0 109.488 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 98.8 m-70 49.11 80.17 0.07 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.772 0.32 . . . . 0.0 110.551 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 123' ' ' GLY . . . . . . . . . . . . . . . -64.01 -40.64 98.39 Favored Glycine 0 CA--C 1.521 0.432 0 N-CA-C 111.01 -0.836 . . . . 0.0 111.01 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 31.2 m -137.68 159.66 34.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.811 0.339 . . . . 0.0 110.492 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 125' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -138.98 143.07 38.36 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.949 0.404 . . . . 0.0 110.555 179.77 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 79.51 0.89 85.43 Favored Glycine 0 CA--C 1.52 0.349 0 N-CA-C 110.971 -0.851 . . . . 0.0 110.971 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 127' ' ' ARG . . . . . . . . . . . . . 14.8 tpt180 -145.8 119.68 9.32 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.821 0.344 . . . . 0.0 110.618 179.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 128' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -155.29 125.45 6.69 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.639 179.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 129' ' ' ARG . . . . . . . . . . . . . 60.8 ttt180 53.96 62.39 9.0 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.526 179.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -67.98 146.88 72.76 Favored 'Trans proline' 0 C--N 1.308 -1.57 0 C-N-CA 122.717 2.278 . . . . 0.0 111.923 -179.815 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 27.0 m 55.08 86.76 0.05 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.601 179.497 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 132' ' ' ALA . . . . . 0.476 ' N ' ' HD2' ' B' ' 133' ' ' PRO . . . -172.66 -62.0 0.0 OUTLIER Pre-proline 0 C--N 1.325 -0.487 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.312 -179.312 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 133' ' ' PRO . . . . . 0.476 ' HD2' ' N ' ' B' ' 132' ' ' ALA . 19.8 Cg_endo -59.39 -31.65 95.23 Favored 'Trans proline' 0 C--N 1.31 -1.462 0 C-N-CA 122.615 2.21 . . . . 0.0 111.886 -179.395 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . 0.563 ' O ' ' N ' ' B' ' 136' ' ' SER . 57.5 mt -106.38 86.8 2.41 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.16 -179.531 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 94.3 m-20 -37.32 -24.68 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.172 0 O-C-N 123.44 0.462 . . . . 0.0 110.646 179.78 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 136' ' ' SER . . . . . 0.563 ' N ' ' O ' ' B' ' 134' ' ' LEU . 44.1 t -44.32 -49.31 9.53 Favored 'General case' 0 C--O 1.241 0.622 0 CA-C-O 121.088 0.47 . . . . 0.0 110.356 179.265 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 9.5 mp0 -64.19 -45.29 88.99 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.058 179.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 138' ' ' ALA . . . . . . . . . . . . . . . -56.3 -28.65 59.49 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.189 -0.459 . . . . 0.0 109.872 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -71.66 -49.93 35.24 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 179.569 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -60.74 -45.48 94.12 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.338 -179.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -60.44 -51.56 68.94 Favored 'General case' 0 C--O 1.24 0.583 0 CA-C-O 121.134 0.492 . . . . 0.0 110.652 -179.361 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 142' ' ' VAL . . . . . 0.48 ' O ' ' OG1' ' B' ' 145' ' ' THR . 95.1 t -60.42 -44.24 95.76 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.308 0 CA-C-N 115.888 -0.597 . . . . 0.0 109.993 179.786 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -56.86 -42.13 79.19 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.733 0.301 . . . . 0.0 110.274 179.69 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 70.4 m -59.08 -44.38 91.88 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.377 -179.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 145' ' ' THR . . . . . 0.48 ' OG1' ' O ' ' B' ' 142' ' ' VAL . 35.4 p -64.33 -51.37 63.73 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.702 179.753 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 146' ' ' LEU . . . . . 0.403 ' N ' ' CD1' ' B' ' 146' ' ' LEU . 7.6 mp -63.68 -21.51 66.42 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.805 179.502 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 147' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -74.68 -59.59 2.66 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.709 179.418 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -58.33 -54.77 43.2 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.685 -179.476 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.478 ' O ' ' O ' ' B' ' 150' ' ' ALA . 8.7 mp -48.42 -30.57 5.19 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.914 -0.314 . . . . 0.0 110.392 -179.891 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 150' ' ' ALA . . . . . 0.482 ' O ' ' O ' ' B' ' 151' ' ' THR . . . -58.08 -138.33 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.456 0 O-C-N 123.611 0.569 . . . . 0.0 110.144 179.702 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 151' ' ' THR . . . . . 0.482 ' O ' ' O ' ' B' ' 150' ' ' ALA . 27.2 m 56.1 117.37 0.01 OUTLIER Pre-proline 0 C--N 1.323 -0.557 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.438 179.636 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -48.25 -47.83 18.61 Favored 'Trans proline' 0 C--N 1.307 -1.624 0 C-N-CA 122.281 1.988 . . . . 0.0 112.901 -179.115 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 77.4 p -58.18 -48.92 78.81 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.933 -178.435 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 1.1 mmp_? -67.39 -37.04 82.51 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.598 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 155' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.24 -53.19 60.63 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.399 -0.52 . . . . 0.0 110.714 -178.347 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 156' ' ' MET . . . . . 0.457 ' C ' ' SD ' ' B' ' 156' ' ' MET . 1.0 OUTLIER -61.15 -45.65 93.77 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.452 179.981 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 92.6 mt -60.93 -43.75 96.51 Favored 'Isoleucine or valine' 0 C--O 1.242 0.667 0 CA-C-O 121.227 0.537 . . . . 0.0 110.434 -179.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 17.0 mt -62.29 -40.13 95.27 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.395 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 19.7 m -59.87 -43.2 94.84 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.158 179.551 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 160' ' ' GLN . . . . . 0.446 ' NE2' ' SD ' ' B' ' 156' ' ' MET . 45.0 mt-30 -57.9 -44.25 86.64 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.077 179.72 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 161' ' ' LEU . . . . . . . . . . . . . 20.0 mt -63.95 -42.89 97.17 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.915 179.02 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 162' ' ' ARG . . . . . 0.519 HH12 ' C ' ' B' ' 217' ' ' LEU . 58.7 ttp180 -62.9 -35.45 80.09 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.253 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 17.1 t-20 -58.19 -44.61 88.16 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.747 -178.649 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . 167.46 -174.86 42.6 Favored Glycine 0 CA--C 1.526 0.777 0 N-CA-C 110.989 -0.844 . . . . 0.0 110.989 179.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -75.51 133.23 15.61 Favored 'Trans proline' 0 N--CA 1.494 1.543 0 C-N-CA 122.839 2.359 . . . . 0.0 111.997 -179.728 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -155.41 99.08 2.3 Favored Pre-proline 0 CA--C 1.539 0.555 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.275 -178.882 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_exo -47.56 165.28 0.12 Allowed 'Trans proline' 0 C--N 1.3 -2.015 0 C-N-CA 122.45 2.1 . . . . 0.0 112.411 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . 87.5 t -48.75 -43.4 14.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.68 -179.683 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 169' ' ' THR . . . . . . . . . . . . . 63.4 p -61.45 -39.52 91.14 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.446 179.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.83 -38.63 91.64 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.151 179.516 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.29 -46.56 88.21 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 120.309 -0.556 . . . . 0.0 110.149 179.771 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 172' ' ' ALA . . . . . 0.55 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -55.45 -47.18 76.46 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 179.435 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 43.8 tp10 -55.43 -50.56 69.48 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.424 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -52.0 -57.22 10.12 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 120.81 -0.356 . . . . 0.0 110.774 -179.592 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 99.1 mt -87.1 -70.99 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.522 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 176' ' ' GLY . . . . . 0.55 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 128.14 94.36 0.81 Allowed Glycine 0 N--CA 1.461 0.357 0 N-CA-C 111.136 -0.786 . . . . 0.0 111.136 179.696 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 83.8 mmm 68.96 86.46 0.13 Allowed 'General case' 0 C--N 1.34 0.189 0 C-N-CA 120.899 -0.32 . . . . 0.0 110.981 178.388 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 47.3 tt0 -172.53 28.01 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.193 179.306 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 72.5 mt-30 -66.75 -23.8 66.13 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.762 -179.531 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 11.9 t -66.53 -44.12 83.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.028 -179.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 181' ' ' ALA . . . . . 0.522 ' O ' ' NE2' ' B' ' 185' ' ' GLN . . . -63.7 -32.39 73.86 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.482 -179.765 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 65.0 t -71.94 -53.56 19.73 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 C-N-CA 120.664 -0.414 . . . . 0.0 110.655 -179.314 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 77.5 p -58.36 -39.92 80.85 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.91 -0.316 . . . . 0.0 110.247 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 184' ' ' HIS . . . . . 0.4 ' ND1' ' OE1' ' B' ' 185' ' ' GLN . 49.6 t-80 -65.68 -51.11 62.0 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.714 179.897 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 185' ' ' GLN . . . . . 0.522 ' NE2' ' O ' ' B' ' 181' ' ' ALA . 0.8 OUTLIER -62.23 -40.62 96.73 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.36 179.835 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 17.5 tp -60.67 -44.61 96.28 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.105 -179.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 21.5 mmt85 -60.99 -41.84 97.26 Favored 'General case' 0 C--O 1.24 0.563 0 CA-C-O 120.81 0.338 . . . . 0.0 110.546 -179.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 87.9 t -61.14 -54.93 28.51 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.177 0 C-N-CA 120.25 -0.58 . . . . 0.0 110.19 -179.517 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 10.5 mp -62.0 -39.68 93.08 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 110.152 -0.314 . . . . 0.0 110.152 179.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 77.1 ttt-85 -51.48 -42.9 61.96 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.03 -179.488 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 55.4 t30 -60.57 -45.57 93.43 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.461 179.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 192' ' ' LEU . . . . . . . . . . . . . 10.1 mt -65.26 -39.36 92.53 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.196 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 91.6 33.2 8.09 Favored Glycine 0 CA--C 1.524 0.61 0 N-CA-C 110.821 -0.912 . . . . 0.0 110.821 -179.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 77.8 mt -97.33 -0.74 45.94 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.513 0.197 . . . . 0.0 110.632 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 24.9 m -134.26 155.58 39.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.263 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 196' ' ' VAL . . . . . . . . . . . . . 76.1 t -125.57 138.98 52.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.128 -179.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 197' ' ' GLY . . . . . . . . . . . . . . . -121.65 130.66 8.19 Favored Glycine 0 N--CA 1.464 0.548 0 N-CA-C 110.823 -0.911 . . . . 0.0 110.823 179.697 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -107.8 99.64 9.09 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 110.305 -0.257 . . . . 0.0 110.305 -179.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 72.7 ttt180 -85.23 126.46 33.69 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.399 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 200' ' ' ALA . . . . . 0.443 ' O ' ' OG ' ' B' ' 203' ' ' SER . . . -173.32 144.5 1.19 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.687 179.614 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 201' ' ' GLY . . . . . 0.518 ' O ' ' N ' ' B' ' 203' ' ' SER . . . 43.63 69.2 0.7 Allowed Glycine 0 C--N 1.329 0.191 0 N-CA-C 110.779 -0.929 . . . . 0.0 110.779 179.771 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 202' ' ' ARG . . . . . 0.432 ' C ' ' O ' ' B' ' 201' ' ' GLY . 15.3 ptp180 33.46 32.6 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.915 0.388 . . . . 0.0 110.869 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 203' ' ' SER . . . . . 0.518 ' N ' ' O ' ' B' ' 201' ' ' GLY . 54.6 p -142.64 123.07 13.97 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.163 -179.163 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 1.8 tp -115.64 123.86 71.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.061 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 89.5 t -99.83 120.96 49.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.609 178.496 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 68.6 m-85 -98.18 125.36 43.19 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.309 179.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 34.2 p -142.68 160.69 39.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.335 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . 6.0 mt -73.17 138.07 45.47 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.751 -179.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 209' ' ' TYR . . . . . 0.461 ' C ' ' CD1' ' B' ' 209' ' ' TYR . 22.3 t80 -63.46 -52.39 61.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.801 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 43.1 m-20 -82.7 142.5 31.61 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.474 -179.339 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 99.3 m -94.6 -24.06 17.37 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-O 121.068 0.461 . . . . 0.0 110.33 179.223 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 212' ' ' HIS . . . . . 0.574 ' CG ' ' ND1' ' A' ' 104' ' ' HIS . 85.6 m-70 -59.5 -43.79 93.27 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.211 179.755 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 213' ' ' VAL . . . . . 0.429 ' CG2' ' N ' ' B' ' 214' ' ' ALA . 15.5 m -56.1 -42.77 73.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.021 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 214' ' ' ALA . . . . . 0.429 ' N ' ' CG2' ' B' ' 213' ' ' VAL . . . -59.9 -46.41 89.44 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.188 179.013 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 68.4 tp60 -61.36 -41.15 96.6 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.019 179.497 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 216' ' ' LEU . . . . . . . . . . . . . 10.0 tp -59.04 -43.99 91.71 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.268 -179.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 217' ' ' LEU . . . . . 0.519 ' C ' HH12 ' B' ' 162' ' ' ARG . 91.3 mt -63.51 -38.96 93.14 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.229 179.709 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 218' ' ' ASP . . . . . 0.478 ' N ' ' NH1' ' B' ' 162' ' ' ARG . 69.3 m-20 -59.66 -41.55 90.84 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.889 0.376 . . . . 0.0 110.603 -179.52 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 219' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -69.52 -54.92 11.81 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.984 179.581 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -58.15 -43.76 87.55 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.4 -179.686 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 221' ' ' ILE . . . . . 0.414 ' CG1' ' O ' ' B' ' 217' ' ' LEU . 4.1 mm -61.47 -45.91 97.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.388 -178.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 86.5 t80 -60.94 -40.14 92.13 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.244 179.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 223' ' ' HIS . . . . . 0.62 ' ND1' ' CG ' ' A' ' 93' ' ' HIS . 41.4 t60 -61.5 -41.92 98.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.032 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 35.6 t -73.63 -40.79 63.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.013 179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 225' ' ' GLU . . . . . 0.441 ' C ' ' H ' ' B' ' 227' ' ' LEU . 11.4 tm-20 -65.29 -31.38 72.49 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.708 -179.746 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 226' ' ' HIS . . . . . 0.524 ' O ' ' CD2' ' B' ' 226' ' ' HIS . 76.2 t60 -68.94 3.84 1.81 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.689 -179.52 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 227' ' ' LEU . . . . . 0.506 ' O ' ' N ' ' B' ' 229' ' ' LEU . 0.6 OUTLIER -40.01 -72.39 0.06 Allowed 'General case' 0 CA--C 1.513 -0.471 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.716 -179.818 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 228' ' ' HIS . . . . . . . . . . . . . 36.6 m80 62.73 -56.31 0.15 Allowed 'General case' 0 C--N 1.334 -0.095 0 O-C-N 124.23 0.956 . . . . 0.0 110.997 179.666 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 229' ' ' LEU . . . . . 0.506 ' N ' ' O ' ' B' ' 227' ' ' LEU . 73.6 mt -58.57 -42.2 87.4 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.598 -179.299 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . 72.83 79.34 0.48 Allowed Glycine 0 CA--C 1.522 0.504 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 179.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 231' ' ' LEU . . . . . 0.549 ' CD2' ' N ' ' B' ' 231' ' ' LEU . 3.7 mm? -76.0 143.94 41.2 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.658 0.266 . . . . 0.0 110.737 -179.842 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 232' ' ' SER . . . . . . . . . . . . . 4.7 m -50.23 87.8 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.405 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 233' ' ' ASP . . . . . 0.512 ' N ' ' O ' ' B' ' 231' ' ' LEU . 97.1 m-20 -88.46 156.09 19.31 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.455 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 234' ' ' ARG . . . . . . . . . . . . . 23.6 ptt180 -75.84 171.18 14.84 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.451 179.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 235' ' ' HIS . . . . . . . . . . . . . 83.7 t60 -132.85 66.42 76.32 Favored Pre-proline 0 N--CA 1.465 0.293 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.533 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 236' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -75.76 156.67 39.68 Favored 'Trans proline' 0 C--N 1.308 -1.592 0 C-N-CA 122.908 2.406 . . . . 0.0 112.026 179.65 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 237' ' ' SER . . . . . 0.429 ' O ' ' O ' ' B' ' 238' ' ' ALA . 23.2 t -153.68 86.67 1.2 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.525 179.443 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 238' ' ' ALA . . . . . 0.429 ' O ' ' O ' ' B' ' 237' ' ' SER . . . 41.91 -165.5 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.654 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.219 -0.796 0 CA-C-O 117.984 -1.453 . . . . 0.0 110.843 179.938 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.303 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 71.4 t60 -83.94 -5.96 59.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.806 0.336 . . . . 0.0 110.562 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -76.51 2.49 57.99 Favored Glycine 0 CA--C 1.524 0.601 0 N-CA-C 110.968 -0.853 . . . . 0.0 110.968 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 27.7 m -64.92 -33.93 66.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 120.948 0.404 . . . . 0.0 110.774 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -62.89 140.49 58.82 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.654 -179.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -177.57 -115.47 0.44 Allowed Glycine 0 CA--C 1.524 0.615 0 N-CA-C 110.945 -0.862 . . . . 0.0 110.945 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.517 ' NH2' ' NH1' ' A' ' 10' ' ' ARG . 84.8 mtp180 -79.46 -9.29 59.58 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.781 0.324 . . . . 0.0 110.521 -179.845 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 65.6 t30 59.59 40.32 20.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.372 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.517 ' NH1' ' NH2' ' A' ' 8' ' ' ARG . 72.3 mtt180 -110.62 150.24 41.44 Favored Pre-proline 0 C--O 1.233 0.193 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.53 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -68.06 153.38 75.15 Favored 'Trans proline' 0 C--N 1.31 -1.447 0 C-N-CA 122.684 2.256 . . . . 0.0 112.057 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 86.4 p -142.34 87.06 1.99 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.317 179.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -169.42 61.73 0.44 Allowed Pre-proline 0 C--N 1.331 -0.213 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.362 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -72.4 113.99 3.87 Favored 'Trans proline' 0 N--CA 1.494 1.552 0 C-N-CA 122.667 2.245 . . . . 0.0 111.85 -179.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.545 ' O ' ' N ' ' A' ' 17' ' ' SER . 38.7 mt -77.6 -143.99 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.277 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 93.7 m-20 -42.43 -17.7 0.01 OUTLIER 'General case' 0 C--O 1.224 -0.267 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.7 179.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.545 ' N ' ' O ' ' A' ' 15' ' ' LEU . 47.6 t -38.74 -49.91 1.62 Allowed 'General case' 0 C--O 1.239 0.518 0 CA-C-O 121.383 0.611 . . . . 0.0 110.606 -179.661 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -64.64 -46.43 82.57 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.003 179.319 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -58.43 -28.65 65.46 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.221 -179.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -70.97 -51.0 28.23 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 120.888 0.375 . . . . 0.0 110.128 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.49 -40.53 96.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.557 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 5.4 tm0? -62.31 -50.43 71.67 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-O 121.417 0.627 . . . . 0.0 110.444 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.478 ' O ' ' OG1' ' A' ' 26' ' ' THR . 93.9 t -61.74 -43.36 97.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.98 179.712 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.71 -41.4 81.67 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 58.9 m -59.47 -45.25 92.16 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.154 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.478 ' OG1' ' O ' ' A' ' 23' ' ' VAL . 22.6 p -63.99 -44.58 92.26 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-O 120.937 0.398 . . . . 0.0 110.442 179.551 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 95.9 mt -67.13 -21.73 65.83 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.332 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 60.1 tt0 -74.49 -58.18 3.45 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.274 179.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.98 -55.19 31.9 Favored 'General case' 0 CA--C 1.52 -0.205 0 C-N-CA 120.511 -0.476 . . . . 0.0 110.276 -179.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.487 ' O ' ' O ' ' A' ' 31' ' ' ALA . 50.3 tp -43.94 -32.34 1.1 Allowed 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 110.12 -0.326 . . . . 0.0 110.12 -178.524 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.487 ' O ' ' O ' ' A' ' 30' ' ' LEU . . . -58.24 -136.2 0.0 OUTLIER 'General case' 0 C--O 1.218 -0.6 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.84 178.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.453 ' O ' ' O ' ' A' ' 31' ' ' ALA . 9.4 m 55.12 113.15 0.02 OUTLIER Pre-proline 0 CA--C 1.538 0.488 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.836 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_exo -47.84 -45.77 23.45 Favored 'Trans proline' 0 C--N 1.309 -1.505 0 C-N-CA 122.395 2.064 . . . . 0.0 113.247 -179.211 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 51.7 m -54.14 -42.89 70.04 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.132 0.492 . . . . 0.0 111.188 -179.338 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.5 mmp_? -68.39 -34.42 76.01 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.066 179.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -64.55 -56.23 15.39 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.431 -0.508 . . . . 0.0 111.84 -179.025 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.498 ' O ' ' OG1' ' A' ' 40' ' ' THR . 3.3 ptm -58.26 -44.06 88.19 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.092 0.473 . . . . 0.0 110.037 179.752 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 92.4 mt -64.02 -43.9 97.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 121.492 0.663 . . . . 0.0 110.144 179.11 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 64.0 tp -59.51 -41.17 89.31 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.927 -179.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.498 ' OG1' ' O ' ' A' ' 37' ' ' MET . 41.4 p -63.93 -35.78 81.78 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.309 -179.754 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 89.8 mm-40 -63.61 -50.81 67.93 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 120.501 -0.48 . . . . 0.0 110.245 179.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 78.9 mt -63.44 -32.86 74.42 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.666 179.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 61.5 ttp180 -53.16 -39.49 63.61 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.197 -179.44 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 43.0 t-20 -61.92 -41.1 97.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.815 0.34 . . . . 0.0 110.593 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 168.5 177.62 39.64 Favored Glycine 0 CA--C 1.527 0.785 0 N-CA-C 111.016 -0.833 . . . . 0.0 111.016 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_endo -69.43 152.38 71.03 Favored 'Trans proline' 0 C--N 1.309 -1.503 0 C-N-CA 122.893 2.395 . . . . 0.0 111.897 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 1.3 pp 178.59 148.28 0.39 Allowed Pre-proline 0 N--CA 1.451 -0.418 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.789 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -72.63 -175.66 1.94 Allowed 'Trans proline' 0 N--CA 1.494 1.547 0 C-N-CA 122.756 2.304 . . . . 0.0 112.208 178.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.695 ' O ' ' N ' ' A' ' 52' ' ' LEU . 33.1 m -75.79 -61.42 1.7 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.582 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.912 179.471 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.673 ' H ' ' CG2' ' A' ' 49' ' ' VAL . 71.8 p -29.32 -46.1 0.05 Allowed 'General case' 0 N--CA 1.475 0.801 0 CA-C-O 121.464 0.649 . . . . 0.0 110.362 -179.449 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -62.33 -43.55 98.55 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.099 178.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.695 ' N ' ' O ' ' A' ' 49' ' ' VAL . 0.2 OUTLIER -61.33 -38.62 87.57 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.846 -179.754 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.533 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -61.53 -43.85 98.12 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.635 -0.505 . . . . 0.0 109.635 179.712 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -57.0 -46.48 82.24 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 179.628 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.28 -49.46 77.74 Favored 'General case' 0 C--O 1.231 0.094 0 C-N-CA 120.73 -0.388 . . . . 0.0 110.248 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 96.3 mt -92.7 -79.22 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.346 179.502 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . 0.533 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 141.76 89.73 0.14 Allowed Glycine 0 CA--C 1.519 0.331 0 N-CA-C 111.171 -0.772 . . . . 0.0 111.171 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 32.0 ttp 69.23 105.94 0.06 Allowed 'General case' 0 CA--C 1.52 -0.21 0 CA-C-O 120.53 0.205 . . . . 0.0 110.682 179.261 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 176.05 10.98 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.528 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -53.8 -37.56 63.64 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.705 -179.293 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 4.8 t -61.45 -48.94 78.83 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.951 -179.548 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.4 -35.68 68.05 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.224 -179.748 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 90.2 t -69.42 -52.96 27.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 C-N-CA 120.524 -0.47 . . . . 0.0 110.778 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.487 ' HG ' ' N ' ' A' ' 65' ' ' HIS . 78.3 p -56.32 -43.32 78.88 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.876 0.369 . . . . 0.0 110.53 -179.79 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . 0.487 ' N ' ' HG ' ' A' ' 64' ' ' SER . 55.9 t-80 -63.76 -51.07 66.51 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.019 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -61.04 -38.4 86.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.417 179.708 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 54.4 tp -60.84 -45.35 94.83 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.428 -179.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 74.1 ttt180 -60.77 -45.37 94.62 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-O 121.091 0.472 . . . . 0.0 110.509 -179.521 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 91.4 t -65.54 -54.5 27.53 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.386 0 C-N-CA 120.203 -0.599 . . . . 0.0 110.583 -179.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 97.7 mt -56.37 -40.73 75.04 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 -179.435 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 59.1 ttt85 -57.83 -39.64 78.15 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.26 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 97.6 m-20 -62.24 -43.54 98.59 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 120.548 -0.461 . . . . 0.0 110.594 -179.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 7.0 mt -65.9 -44.72 84.4 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-O 120.953 0.406 . . . . 0.0 110.587 -179.29 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 104.15 96.56 2.41 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 111.612 -0.595 . . . . 0.0 111.612 179.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -171.92 -6.11 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.898 0.38 . . . . 0.0 110.654 179.205 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 30.8 m -138.83 157.62 29.52 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.19 179.656 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 61.2 t -143.82 155.59 15.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.432 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -126.41 144.89 15.4 Favored Glycine 0 N--CA 1.462 0.429 0 N-CA-C 110.446 -1.062 . . . . 0.0 110.446 179.378 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 -103.56 117.48 34.51 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 110.349 -0.241 . . . . 0.0 110.349 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 61.7 ttp180 -96.82 136.6 37.14 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.541 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -145.5 95.66 2.7 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.628 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 60.61 -85.83 0.02 OUTLIER Glycine 0 CA--C 1.523 0.563 0 N-CA-C 110.71 -0.956 . . . . 0.0 110.71 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 85.0 mtp180 -129.45 12.29 5.92 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.615 0.245 . . . . 0.0 110.648 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 50.6 m -117.47 108.84 16.01 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-O 120.914 0.387 . . . . 0.0 110.485 179.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 2.7 tp -117.34 130.46 72.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.832 179.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 20.1 m -123.05 159.39 27.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.355 179.146 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 27.7 m-85 -115.75 136.58 52.91 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.463 -179.66 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 20.1 m -151.07 171.95 16.51 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.193 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.521 ' N ' ' CD1' ' A' ' 89' ' ' LEU . 8.3 mp -74.8 146.64 41.89 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.494 -179.91 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 58.6 t80 -52.18 -47.52 65.5 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.493 179.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.576 ' CG ' ' H ' ' A' ' 92' ' ' THR . 43.4 t0 -155.4 -177.42 6.54 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.387 -179.799 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' THR . . . . . 0.576 ' H ' ' CG ' ' A' ' 91' ' ' ASP . 5.5 t -77.48 6.84 6.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.451 -179.808 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . 0.552 ' CG ' ' CE1' ' B' ' 223' ' ' HIS . 34.9 m80 -62.27 -73.39 0.11 Allowed 'General case' 0 C--O 1.236 0.345 0 CA-C-O 120.976 0.417 . . . . 0.0 110.308 179.889 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 82.4 t -45.22 -40.19 2.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.29 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.46 -39.61 93.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.524 179.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 8.8 tp-100 -60.54 -47.43 86.2 Favored 'General case' 0 C--O 1.241 0.632 0 CA-C-O 121.095 0.474 . . . . 0.0 110.176 -179.412 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.515 ' N ' ' CD1' ' A' ' 97' ' ' LEU . 7.2 mp -62.86 -43.28 99.22 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.263 -179.626 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 7.0 tp -63.58 -39.7 95.07 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.029 179.828 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 47.4 t0 -56.48 -47.63 78.82 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.169 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.531 ' N ' ' OE1' ' A' ' 100' ' ' GLU . 0.3 OUTLIER -63.33 -51.56 65.45 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 120.639 -0.425 . . . . 0.0 110.279 179.678 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -56.48 -43.01 79.23 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.575 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 4.1 mm -61.45 -45.6 98.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 C-N-CA 120.512 -0.475 . . . . 0.0 110.502 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 85.1 t80 -61.85 -45.02 95.62 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.981 0.42 . . . . 0.0 110.449 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . 0.534 ' CE1' ' CG ' ' B' ' 212' ' ' HIS . 13.9 t60 -55.43 -45.24 76.78 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.601 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 35.3 t -76.07 -33.64 59.56 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.859 179.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 78.7 tt0 -58.88 -38.93 79.94 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.378 -179.471 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . 0.427 ' O ' ' O ' ' A' ' 108' ' ' LEU . 7.6 t60 -55.03 -71.62 0.08 Allowed 'General case' 0 CA--C 1.521 -0.168 0 C-N-CA 120.503 -0.479 . . . . 0.0 110.159 -179.289 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.485 ' CD2' ' N ' ' A' ' 108' ' ' LEU . 4.0 mm? -56.8 -110.21 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.062 -179.656 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . 0.453 ' O ' ' CG ' ' A' ' 109' ' ' HIS . 83.8 t60 37.44 41.11 0.24 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.841 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 1.8 pp -67.81 -36.46 80.44 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.259 -179.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 147.08 42.66 0.04 OUTLIER Glycine 0 CA--C 1.523 0.548 0 N-CA-C 110.985 -0.846 . . . . 0.0 110.985 -179.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -101.38 175.95 5.4 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 121.028 0.442 . . . . 0.0 110.242 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 23.1 m -102.53 114.22 28.24 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.415 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -64.78 -37.46 87.68 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.551 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 7.6 ptm180 -149.86 135.05 18.06 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.159 0.504 . . . . 0.0 110.715 -179.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . 0.576 ' N ' ' CD ' ' A' ' 117' ' ' PRO . 0.0 OUTLIER 169.37 -46.16 0.0 OUTLIER Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.809 -179.806 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . 0.576 ' CD ' ' N ' ' A' ' 116' ' ' HIS . 31.9 Cg_exo -56.81 -47.47 23.23 Favored 'Trans proline' 0 C--N 1.311 -1.436 0 C-N-CA 122.522 2.148 . . . . 0.0 111.903 -178.456 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 43.3 t -63.07 -43.99 97.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.674 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -66.82 142.3 57.4 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.542 -179.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.708 0 CA-C-O 117.991 -1.45 . . . . 0.0 110.917 179.963 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.332 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 70.1 t60 -85.07 -4.87 59.31 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.779 0.323 . . . . 0.0 110.623 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 123' ' ' GLY . . . . . . . . . . . . . . . -77.26 1.95 63.22 Favored Glycine 0 CA--C 1.525 0.71 0 N-CA-C 110.945 -0.862 . . . . 0.0 110.945 -179.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 27.3 m -64.53 -38.41 82.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 120.906 0.384 . . . . 0.0 110.773 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 125' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -58.59 141.1 53.2 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.582 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -178.86 -115.37 0.46 Allowed Glycine 0 CA--C 1.525 0.699 0 N-CA-C 110.913 -0.875 . . . . 0.0 110.913 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 127' ' ' ARG . . . . . 0.557 ' NH2' ' NH1' ' B' ' 129' ' ' ARG . 85.3 mtp180 -79.19 -8.08 58.73 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.86 0.362 . . . . 0.0 110.573 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 128' ' ' ASN . . . . . . . . . . . . . 66.4 t30 57.92 41.45 24.53 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.494 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 129' ' ' ARG . . . . . 0.557 ' NH1' ' NH2' ' B' ' 127' ' ' ARG . 81.0 mtt180 -112.01 150.29 42.17 Favored Pre-proline 0 CA--C 1.531 0.223 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.538 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -67.91 154.73 72.15 Favored 'Trans proline' 0 N--CA 1.492 1.401 0 C-N-CA 122.646 2.23 . . . . 0.0 111.903 179.622 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 63.8 p -143.93 86.21 1.85 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.501 179.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 132' ' ' ALA . . . . . . . . . . . . . . . -169.04 65.11 0.58 Allowed Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.41 179.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 133' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -74.9 113.75 3.87 Favored 'Trans proline' 0 N--CA 1.493 1.469 0 C-N-CA 122.606 2.204 . . . . 0.0 112.042 -179.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . 0.546 ' O ' ' N ' ' B' ' 136' ' ' SER . 38.9 mt -77.03 -144.67 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.311 -179.859 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 97.0 m-20 -42.58 -17.51 0.01 OUTLIER 'General case' 0 C--O 1.224 -0.28 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.746 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 136' ' ' SER . . . . . 0.546 ' N ' ' O ' ' B' ' 134' ' ' LEU . 27.3 t -39.32 -49.89 1.99 Allowed 'General case' 0 C--O 1.238 0.49 0 CA-C-O 121.439 0.637 . . . . 0.0 110.479 -179.655 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -64.23 -45.99 85.8 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.902 179.352 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 138' ' ' ALA . . . . . . . . . . . . . . . -58.74 -28.27 65.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.419 -179.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -71.39 -50.74 29.02 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-O 120.85 0.357 . . . . 0.0 110.168 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -62.78 -40.95 98.91 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.522 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 4.7 tm0? -61.68 -51.19 69.46 Favored 'General case' 0 C--O 1.24 0.586 0 CA-C-O 121.395 0.617 . . . . 0.0 110.457 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 142' ' ' VAL . . . . . 0.478 ' O ' ' OG1' ' B' ' 145' ' ' THR . 85.8 t -61.32 -44.33 98.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.013 179.844 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -56.38 -41.34 76.07 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 62.1 m -59.32 -45.36 91.53 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.178 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 145' ' ' THR . . . . . 0.478 ' OG1' ' O ' ' B' ' 142' ' ' VAL . 46.9 p -64.0 -44.87 91.34 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.311 179.434 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 96.0 mt -66.4 -22.41 66.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.425 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 147' ' ' GLN . . . . . . . . . . . . . 59.5 tt0 -74.12 -59.08 2.89 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.29 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -60.78 -55.01 38.18 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 120.571 -0.452 . . . . 0.0 110.308 -179.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.475 ' O ' ' O ' ' B' ' 150' ' ' ALA . 47.8 tp -44.31 -31.3 0.99 Allowed 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 120.914 -0.314 . . . . 0.0 110.212 -178.684 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 150' ' ' ALA . . . . . 0.475 ' O ' ' O ' ' B' ' 149' ' ' LEU . . . -59.16 -135.93 0.0 OUTLIER 'General case' 0 C--O 1.219 -0.524 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.614 179.07 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 151' ' ' THR . . . . . 0.454 ' O ' ' O ' ' B' ' 150' ' ' ALA . 10.1 m 53.97 113.31 0.01 OUTLIER Pre-proline 0 CA--C 1.538 0.505 0 CA-C-N 116.574 -0.284 . . . . 0.0 110.67 179.915 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -48.68 -46.89 22.63 Favored 'Trans proline' 0 C--N 1.309 -1.503 0 C-N-CA 122.169 1.913 . . . . 0.0 113.209 -178.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 66.8 m -52.91 -38.77 62.18 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.541 0.686 . . . . 0.0 111.052 -179.359 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 3.5 mmp_? -71.75 -35.15 70.02 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.993 179.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 155' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -64.16 -55.77 19.46 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.43 -0.508 . . . . 0.0 111.603 -179.046 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 156' ' ' MET . . . . . 0.475 ' O ' ' OG1' ' B' ' 159' ' ' THR . 0.1 OUTLIER -56.73 -46.26 81.42 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 179.677 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 97.4 mt -62.82 -43.04 98.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 C-N-CA 120.199 -0.6 . . . . 0.0 110.209 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 58.4 tp -60.8 -42.59 97.93 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.287 -179.509 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 159' ' ' THR . . . . . 0.475 ' OG1' ' O ' ' B' ' 156' ' ' MET . 37.1 p -62.37 -35.37 78.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.112 -179.884 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 91.6 mm-40 -65.01 -50.75 65.04 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.965 0.412 . . . . 0.0 110.405 179.434 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 161' ' ' LEU . . . . . . . . . . . . . 82.2 mt -62.61 -32.64 73.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.72 179.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 162' ' ' ARG . . . . . . . . . . . . . 61.8 ttp180 -53.59 -39.04 64.52 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.33 -179.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 54.9 t-20 -61.19 -41.11 96.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.945 0.402 . . . . 0.0 110.405 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . 164.55 -176.7 40.38 Favored Glycine 0 CA--C 1.525 0.692 0 N-CA-C 111.12 -0.792 . . . . 0.0 111.12 179.433 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_exo -66.7 150.4 83.6 Favored 'Trans proline' 0 C--N 1.308 -1.6 0 C-N-CA 122.964 2.443 . . . . 0.0 111.937 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 1.7 pp -177.39 146.3 0.63 Allowed Pre-proline 0 N--CA 1.449 -0.509 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.573 178.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -74.53 174.99 11.66 Favored 'Trans proline' 0 N--CA 1.493 1.495 0 C-N-CA 122.873 2.382 . . . . 0.0 112.167 179.546 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . 3.6 m -71.42 -32.77 47.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 121.945 0.879 . . . . 0.0 110.808 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 169' ' ' THR . . . . . . . . . . . . . 50.4 p -58.16 -39.97 80.2 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-N 114.563 -1.199 . . . . 0.0 110.465 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 68.1 m-20 -68.53 -37.97 80.44 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.588 179.625 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.76 -38.59 91.66 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.096 -179.365 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 172' ' ' ALA . . . . . 0.517 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -62.81 -46.64 87.01 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.661 179.85 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -56.12 -44.66 79.35 Favored 'General case' 0 C--O 1.232 0.151 0 C-N-CA 120.46 -0.496 . . . . 0.0 109.943 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -59.96 -50.32 74.21 Favored 'General case' 0 C--O 1.231 0.091 0 C-N-CA 120.664 -0.414 . . . . 0.0 110.438 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 97.1 mt -93.35 -78.24 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.187 179.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 176' ' ' GLY . . . . . 0.517 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 142.29 91.62 0.17 Allowed Glycine 0 CA--C 1.519 0.336 0 N-CA-C 111.441 -0.664 . . . . 0.0 111.441 179.779 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 32.7 ttp 66.83 107.6 0.04 OUTLIER 'General case' 0 CA--C 1.518 -0.268 0 CA-C-O 120.66 0.267 . . . . 0.0 110.905 179.169 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 174.63 12.43 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.618 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -54.53 -38.14 66.22 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.61 -179.415 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 38.2 m -60.65 -48.29 82.43 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.855 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -57.08 -35.28 69.19 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.129 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 86.2 t -69.89 -53.37 24.31 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.774 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 77.6 p -57.14 -42.14 80.43 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.965 0.412 . . . . 0.0 110.572 -179.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 57.6 t-80 -63.92 -50.7 67.68 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-O 121.054 0.454 . . . . 0.0 110.794 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 85.6 mt-30 -62.3 -38.74 90.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.35 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 186' ' ' LEU . . . . . 0.401 ' CD2' ' CD1' ' B' ' 206' ' ' TYR . 58.1 tp -60.2 -45.14 94.18 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.219 -179.784 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 75.5 ttt180 -60.84 -44.45 96.95 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-O 121.135 0.493 . . . . 0.0 110.453 -179.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 88.9 t -66.74 -54.21 27.52 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.486 0 C-N-CA 120.121 -0.632 . . . . 0.0 110.709 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 97.7 mt -56.72 -41.32 77.25 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 -179.253 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 59.6 ttt85 -57.96 -39.97 79.42 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.237 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -61.19 -42.53 98.74 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 120.506 -0.478 . . . . 0.0 110.721 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 192' ' ' LEU . . . . . . . . . . . . . 6.1 mt -66.96 -42.38 85.3 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.958 0.409 . . . . 0.0 110.5 -179.284 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 101.82 95.47 2.26 Favored Glycine 0 CA--C 1.524 0.647 0 N-CA-C 111.474 -0.65 . . . . 0.0 111.474 179.65 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -170.71 -7.93 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.924 0.393 . . . . 0.0 110.586 179.139 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 22.4 m -136.79 156.11 34.45 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.08 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 196' ' ' VAL . . . . . . . . . . . . . 66.5 t -143.53 155.34 16.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.39 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 197' ' ' GLY . . . . . . . . . . . . . . . -127.03 146.37 16.32 Favored Glycine 0 N--CA 1.463 0.484 0 N-CA-C 110.351 -1.099 . . . . 0.0 110.351 179.519 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 96.6 m-20 -103.32 116.37 32.3 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 120.606 0.241 . . . . 0.0 110.489 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 61.4 ttp180 -95.52 135.69 36.85 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.168 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 200' ' ' ALA . . . . . . . . . . . . . . . -145.4 94.79 2.56 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.503 -179.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 201' ' ' GLY . . . . . . . . . . . . . . . 61.8 -90.12 0.05 OUTLIER Glycine 0 CA--C 1.523 0.558 0 N-CA-C 110.629 -0.988 . . . . 0.0 110.629 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 202' ' ' ARG . . . . . . . . . . . . . 83.7 mtp180 -125.45 13.98 8.2 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.639 0.257 . . . . 0.0 110.66 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 43.1 m -119.93 111.67 18.22 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-O 120.926 0.393 . . . . 0.0 110.382 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 2.4 tp -120.21 130.2 74.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.948 179.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 23.5 m -122.01 158.86 25.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.429 178.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 206' ' ' TYR . . . . . 0.401 ' CD1' ' CD2' ' B' ' 186' ' ' LEU . 40.5 m-85 -114.22 137.63 51.53 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.646 -179.51 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 14.9 m -151.75 172.0 16.82 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.343 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 208' ' ' LEU . . . . . 0.522 ' N ' ' CD1' ' B' ' 208' ' ' LEU . 8.4 mp -75.79 148.11 38.7 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.555 179.763 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 67.5 t80 -52.71 -46.71 67.45 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.358 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 210' ' ' ASP . . . . . 0.544 ' CG ' ' H ' ' B' ' 211' ' ' THR . 43.5 t0 -157.01 -177.4 6.59 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.807 0.337 . . . . 0.0 110.505 -179.827 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 211' ' ' THR . . . . . 0.544 ' H ' ' CG ' ' B' ' 210' ' ' ASP . 4.8 t -77.09 4.77 9.48 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.483 -179.861 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 212' ' ' HIS . . . . . 0.534 ' CG ' ' CE1' ' A' ' 104' ' ' HIS . 35.1 m80 -60.35 -74.72 0.07 Allowed 'General case' 0 C--O 1.237 0.395 0 CA-C-O 121.016 0.436 . . . . 0.0 110.327 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 71.3 t -44.5 -39.82 1.78 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.352 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 214' ' ' ALA . . . . . . . . . . . . . . . -63.26 -39.4 94.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.501 179.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 215' ' ' GLN . . . . . 0.4 ' N ' ' O ' ' B' ' 212' ' ' HIS . 8.8 tp-100 -59.87 -47.51 85.44 Favored 'General case' 0 C--O 1.24 0.559 0 CA-C-O 121.146 0.498 . . . . 0.0 110.013 -179.521 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 216' ' ' LEU . . . . . 0.514 ' CD1' ' N ' ' B' ' 216' ' ' LEU . 7.3 mp -62.75 -42.62 99.76 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.146 -179.548 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 6.5 tp -63.73 -38.74 92.23 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.085 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 64.0 t0 -57.81 -46.19 85.03 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.928 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 219' ' ' GLU . . . . . 0.527 ' OE1' ' N ' ' B' ' 219' ' ' GLU . 0.3 OUTLIER -64.76 -50.72 65.73 Favored 'General case' 0 N--CA 1.462 0.163 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.37 179.631 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -57.75 -42.79 84.66 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 120.876 0.369 . . . . 0.0 110.565 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 4.1 mm -62.07 -44.36 98.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.6 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 80.2 t80 -62.22 -44.55 96.32 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.965 0.412 . . . . 0.0 110.324 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 223' ' ' HIS . . . . . 0.552 ' CE1' ' CG ' ' A' ' 93' ' ' HIS . 13.2 t60 -56.29 -44.9 80.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.675 -179.799 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 27.2 t -75.55 -36.34 60.47 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.939 179.669 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 80.3 tt0 -56.81 -37.93 71.88 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.308 -179.399 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 226' ' ' HIS . . . . . 0.425 ' O ' ' O ' ' B' ' 227' ' ' LEU . 9.1 t60 -56.01 -71.81 0.08 Allowed 'General case' 0 C--N 1.332 -0.175 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.094 -179.467 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 227' ' ' LEU . . . . . 0.473 ' CD2' ' N ' ' B' ' 227' ' ' LEU . 4.1 mm? -56.88 -109.55 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.03 -179.634 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 228' ' ' HIS . . . . . 0.469 ' CG ' ' O ' ' B' ' 228' ' ' HIS . 82.9 t60 36.74 41.19 0.16 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.721 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 229' ' ' LEU . . . . . . . . . . . . . 1.8 pp -67.65 -34.39 76.85 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.534 -179.771 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . 145.3 41.06 0.05 OUTLIER Glycine 0 CA--C 1.523 0.533 0 N-CA-C 111.121 -0.792 . . . . 0.0 111.121 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 231' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -99.81 -179.78 4.28 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 232' ' ' SER . . . . . . . . . . . . . 70.4 m -110.12 114.37 27.81 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.469 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 233' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -64.49 -40.19 95.21 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.459 179.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 234' ' ' ARG . . . . . . . . . . . . . 7.9 ptm180 -142.38 136.89 30.04 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.113 0.482 . . . . 0.0 110.453 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 235' ' ' HIS . . . . . 0.544 ' N ' ' HD2' ' B' ' 236' ' ' PRO . 0.1 OUTLIER 170.06 -59.17 0.0 OUTLIER Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.013 -178.926 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 236' ' ' PRO . . . . . 0.544 ' HD2' ' N ' ' B' ' 235' ' ' HIS . 13.9 Cg_endo -55.26 -42.09 72.0 Favored 'Trans proline' 0 C--N 1.311 -1.42 0 C-N-CA 122.579 2.186 . . . . 0.0 111.818 -178.521 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 237' ' ' SER . . . . . . . . . . . . . 11.5 t -62.17 -44.55 96.36 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.467 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 238' ' ' ALA . . . . . . . . . . . . . . . -70.99 144.6 50.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.467 179.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.218 -0.849 0 CA-C-O 117.99 -1.45 . . . . 0.0 110.968 -179.965 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.219 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 4.6 p80 -151.91 162.06 41.66 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.911 0.386 . . . . 0.0 110.557 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 56.18 102.04 0.01 OUTLIER Glycine 0 CA--C 1.524 0.65 0 N-CA-C 110.932 -0.867 . . . . 0.0 110.932 -180.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 11.9 p -62.37 -32.67 55.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.995 0.426 . . . . 0.0 110.71 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -61.32 -174.61 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.686 179.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -173.95 176.1 46.45 Favored Glycine 0 CA--C 1.524 0.599 0 N-CA-C 111.006 -0.838 . . . . 0.0 111.006 -179.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 89.0 mtm180 -79.83 57.89 2.69 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.757 0.313 . . . . 0.0 110.43 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 95.3 m-20 -62.52 -41.78 99.07 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.383 -179.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.791 ' H ' ' HE ' ' A' ' 10' ' ' ARG . 2.3 mmp_? 40.43 59.21 7.65 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.665 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -71.21 16.72 0.29 Allowed 'Trans proline' 0 C--N 1.306 -1.665 0 C-N-CA 122.717 2.278 . . . . 0.0 112.043 -179.444 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.473 ' H ' ' C ' ' A' ' 10' ' ' ARG . 73.9 p -119.0 7.02 11.33 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.822 -179.813 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.624 ' N ' ' CD ' ' A' ' 14' ' ' PRO . . . -73.6 -42.14 6.25 Favored Pre-proline 0 C--N 1.323 -0.567 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.684 179.325 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.624 ' CD ' ' N ' ' A' ' 13' ' ' ALA . 31.4 Cg_exo -57.84 141.91 96.05 Favored 'Trans proline' 0 C--N 1.312 -1.348 0 C-N-CA 122.61 2.207 . . . . 0.0 111.703 -179.057 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.523 ' O ' ' N ' ' A' ' 17' ' ' SER . 0.1 OUTLIER -107.26 -71.26 0.76 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.26 -179.93 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.429 ' C ' ' O ' ' A' ' 15' ' ' LEU . 97.2 m-20 -34.59 -31.28 0.01 OUTLIER 'General case' 0 C--N 1.339 0.151 0 O-C-N 123.469 0.481 . . . . 0.0 110.599 -179.25 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.523 ' N ' ' O ' ' A' ' 15' ' ' LEU . 88.7 p -44.09 -50.05 8.63 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 121.334 0.588 . . . . 0.0 110.066 179.216 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -63.91 -44.46 92.87 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.191 179.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -57.39 -29.51 64.14 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.407 179.785 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -72.96 -50.58 22.51 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 120.885 0.374 . . . . 0.0 110.205 179.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.75 -41.98 95.5 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.912 179.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 72.6 tp60 -64.64 -52.94 54.73 Favored 'General case' 0 C--O 1.242 0.664 0 CA-C-O 121.255 0.55 . . . . 0.0 110.622 -179.399 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 93.0 t -63.17 -45.94 97.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.994 -179.808 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -53.43 -43.17 67.8 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.195 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 49.2 m -59.9 -44.15 94.43 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.799 0.333 . . . . 0.0 110.47 179.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 95.6 m -63.8 -51.0 66.75 Favored 'General case' 0 C--O 1.238 0.478 0 C-N-CA 120.619 -0.432 . . . . 0.0 110.835 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.431 ' N ' ' CD1' ' A' ' 27' ' ' LEU . 7.8 mp -66.94 -19.77 65.78 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.703 179.77 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 55.8 tt0 -74.82 -59.91 2.52 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.636 179.4 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -57.12 -52.15 66.46 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.445 -179.566 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 97.0 mt -54.81 -39.75 68.81 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.226 -179.173 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.561 ' O ' ' C ' ' A' ' 32' ' ' THR . . . -40.25 -73.33 0.05 OUTLIER 'General case' 0 CA--C 1.514 -0.442 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.299 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.561 ' C ' ' O ' ' A' ' 31' ' ' ALA . 94.9 m -2.98 107.08 0.03 OUTLIER Pre-proline 0 CA--C 1.539 0.533 0 O-C-N 124.556 1.16 . . . . 0.0 111.098 -179.339 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -44.19 -50.37 7.79 Favored 'Trans proline' 0 C--N 1.308 -1.577 0 C-N-CA 122.289 1.993 . . . . 0.0 113.039 -177.378 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 10.0 t -58.39 -46.78 85.7 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.034 -179.527 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 50.6 ttm-85 -64.09 -43.66 94.73 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.388 -179.505 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.43 ' CD2' ' HG1' ' A' ' 40' ' ' THR . 2.1 tt -61.09 -52.26 65.66 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.468 -0.493 . . . . 0.0 110.545 -178.915 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 49.0 ttp -53.87 -47.0 71.48 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.737 -0.385 . . . . 0.0 110.754 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 88.1 mt -60.81 -47.71 92.04 Favored 'Isoleucine or valine' 0 C--O 1.239 0.534 0 CA-C-O 121.36 0.6 . . . . 0.0 110.687 -179.254 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -62.56 -41.06 98.68 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.691 179.682 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.43 ' HG1' ' CD2' ' A' ' 36' ' ' LEU . 75.4 m -59.21 -40.53 86.09 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.861 179.799 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 53.6 tp60 -61.55 -44.99 96.04 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.311 -0.404 . . . . 0.0 109.989 -179.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.443 ' O ' ' N ' ' A' ' 44' ' ' ASN . 9.7 mt -66.83 -24.29 66.14 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.971 179.634 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.432 ' C ' ' O ' ' A' ' 42' ' ' LEU . 72.1 ttp85 -33.78 -35.71 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 O-C-N 123.578 0.549 . . . . 0.0 111.063 -179.347 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.443 ' N ' ' O ' ' A' ' 42' ' ' LEU . 58.0 t-20 -62.2 -72.92 0.11 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.212 179.26 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.429 ' H ' ' CD1' ' A' ' 47' ' ' LEU . . . 153.74 -75.07 0.24 Allowed Glycine 0 CA--C 1.526 0.778 0 N-CA-C 111.206 -0.758 . . . . 0.0 111.206 179.515 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.402 ' C ' ' CD1' ' A' ' 47' ' ' LEU . 71.6 Cg_endo -81.19 98.53 1.03 Allowed 'Trans proline' 0 C--N 1.312 -1.377 0 C-N-CA 122.655 2.237 . . . . 0.0 112.349 179.108 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.429 ' CD1' ' H ' ' A' ' 45' ' ' GLY . 5.1 mp -145.61 69.4 13.62 Favored Pre-proline 0 N--CA 1.465 0.28 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.236 179.475 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_exo -45.81 163.89 0.08 OUTLIER 'Trans proline' 0 C--N 1.308 -1.575 0 C-N-CA 122.563 2.175 . . . . 0.0 112.038 179.681 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 91.5 t -54.4 -47.07 70.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 121.129 0.49 . . . . 0.0 110.373 -178.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 66.4 p -63.98 -34.81 78.83 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.454 179.301 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -67.62 -39.94 84.68 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.807 179.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 16.5 mt -62.89 -40.01 96.22 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.925 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.569 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -59.67 -48.1 83.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.982 -0.554 . . . . 0.0 109.533 179.384 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 42.6 tp10 -56.91 -46.04 82.23 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.549 -0.46 . . . . 0.0 109.991 179.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -63.38 -51.21 66.8 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 120.73 -0.388 . . . . 0.0 110.662 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 97.5 mt -81.28 -71.0 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.519 -180.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . 0.569 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 130.53 75.01 0.14 Allowed Glycine 0 N--CA 1.463 0.449 0 N-CA-C 111.206 -0.757 . . . . 0.0 111.206 179.546 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 8.8 ttp 73.87 103.07 0.07 Allowed 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 120.993 -0.283 . . . . 0.0 110.848 179.343 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 179.89 17.68 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.383 179.608 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 9.2 mt-30 -51.75 -32.09 29.21 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.8 -179.349 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 50.9 m -66.8 -43.56 83.59 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.91 179.845 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.87 -30.66 71.73 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.252 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 75.1 t -72.78 -52.84 20.94 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.235 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.579 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 69.4 m -56.35 -45.33 80.48 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.416 -179.292 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 62.9 m-70 -62.87 -49.73 73.68 Favored 'General case' 0 C--O 1.239 0.501 0 CA-C-O 121.214 0.531 . . . . 0.0 111.004 179.786 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -62.49 -38.73 91.01 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.233 -179.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.5 tt -61.57 -43.34 99.04 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.646 -179.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -61.69 -42.02 98.37 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.934 -0.306 . . . . 0.0 110.616 179.77 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 89.2 t -64.48 -55.04 23.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 C-N-CA 120.135 -0.626 . . . . 0.0 110.678 -179.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 10.8 mp -61.73 -41.04 97.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.961 0.41 . . . . 0.0 110.132 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 79.0 ttt-85 -56.19 -41.72 76.01 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.094 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 8.2 t-20 -58.25 -49.89 75.51 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.6 -0.44 . . . . 0.0 110.228 -179.563 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.49 ' CD2' ' N ' ' A' ' 73' ' ' LEU . 4.0 mm? -68.09 -41.64 81.55 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.816 179.29 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 105.12 43.24 1.66 Allowed Glycine 0 CA--C 1.524 0.648 0 N-CA-C 111.076 -0.81 . . . . 0.0 111.076 -179.776 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.45 ' N ' ' CD1' ' A' ' 75' ' ' LEU . 9.0 mp -97.4 -15.22 20.77 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 110.448 -0.204 . . . . 0.0 110.448 179.378 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 30.5 m -136.83 160.22 36.95 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.344 0 CA-C-O 120.801 0.334 . . . . 0.0 110.334 -179.85 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.412 ' CG1' ' N ' ' A' ' 78' ' ' GLY . 51.5 t -140.16 155.48 23.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.356 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . 0.412 ' N ' ' CG1' ' A' ' 77' ' ' VAL . . . -126.66 149.67 17.64 Favored Glycine 0 CA--C 1.521 0.431 0 N-CA-C 110.515 -1.034 . . . . 0.0 110.515 179.612 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -113.64 107.87 16.36 Favored 'General case' 0 C--O 1.236 0.388 0 N-CA-C 110.256 -0.276 . . . . 0.0 110.256 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 15.1 tpt180 -73.5 132.05 42.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.595 -179.674 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -145.83 94.61 2.51 Favored 'General case' 0 CA--C 1.522 -0.119 0 CA-C-O 120.784 0.326 . . . . 0.0 110.328 179.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 58.32 -118.46 13.55 Favored Glycine 0 CA--C 1.522 0.491 0 N-CA-C 110.839 -0.904 . . . . 0.0 110.839 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 84.2 mtt85 -98.8 17.31 19.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.614 0.245 . . . . 0.0 110.725 179.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 2.5 t -139.66 142.82 36.95 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-O 120.942 0.401 . . . . 0.0 110.554 -179.606 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.447 ' CD1' ' CE1' ' A' ' 87' ' ' TYR . 0.0 OUTLIER -138.79 145.2 28.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.501 179.748 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 77.3 t -114.13 134.45 56.97 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.653 -179.651 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.447 ' CE1' ' CD1' ' A' ' 85' ' ' ILE . 84.2 m-85 -99.51 130.02 45.72 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.198 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 31.3 p -146.01 165.77 28.03 Favored 'General case' 0 C--O 1.224 -0.263 0 N-CA-C 109.816 -0.439 . . . . 0.0 109.816 -179.379 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.519 ' N ' ' CD1' ' A' ' 89' ' ' LEU . 8.0 mp -67.53 147.5 52.72 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.369 -179.416 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 61.3 t80 -50.55 -42.38 55.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.426 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 46.8 p30 -146.71 179.68 7.4 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.508 -0.315 . . . . 0.0 110.4 -179.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 28.1 m -95.27 -17.65 21.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.499 -179.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . 0.478 ' CG ' ' HD1' ' B' ' 223' ' ' HIS . 92.2 m-70 -40.97 -66.1 0.36 Allowed 'General case' 0 C--O 1.235 0.322 0 CA-C-O 121.368 0.604 . . . . 0.0 110.964 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 8.3 p -47.5 -34.89 3.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.347 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.08 -39.75 94.73 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.303 179.569 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -59.47 -45.43 91.66 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.919 -179.773 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.489 ' N ' ' CD1' ' A' ' 97' ' ' LEU . 8.3 mp -60.74 -44.15 97.03 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.336 -0.546 . . . . 0.0 109.875 -179.315 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 6.1 tp -64.8 -38.33 90.62 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.526 179.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 63.9 t0 -57.05 -46.57 82.32 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.984 -179.487 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -70.32 -47.86 59.2 Favored 'General case' 0 C--O 1.232 0.152 0 C-N-CA 120.566 -0.454 . . . . 0.0 110.105 179.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -53.46 -47.87 69.35 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.461 179.602 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 4.3 mm -63.09 -44.59 99.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 C-N-CA 120.626 -0.43 . . . . 0.0 110.64 -179.511 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 86.5 t80 -60.37 -41.42 93.68 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.018 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . 0.504 ' HD1' ' CG ' ' B' ' 212' ' ' HIS . 64.7 t60 -69.28 -39.85 78.1 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.716 179.61 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.489 ' O ' ' N ' ' A' ' 109' ' ' HIS . 48.3 t -57.86 -47.82 81.59 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.544 -178.965 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . 0.502 ' C ' ' H ' ' A' ' 108' ' ' LEU . 98.3 mt-10 -76.89 -54.45 6.58 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.94 0.4 . . . . 0.0 111.411 179.212 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 83.6 t60 -48.75 -13.11 0.05 OUTLIER 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.268 -178.762 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.502 ' H ' ' C ' ' A' ' 106' ' ' GLU . 64.2 mt -142.92 -74.39 0.28 Allowed 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.801 179.737 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . 0.489 ' N ' ' O ' ' A' ' 105' ' ' SER . 15.2 t-80 78.37 74.67 0.06 Allowed 'General case' 0 C--N 1.33 -0.264 0 O-C-N 123.45 0.469 . . . . 0.0 110.488 -179.827 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.491 ' CD1' ' N ' ' A' ' 110' ' ' LEU . 9.6 mp -63.08 -42.82 99.72 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.888 0.375 . . . . 0.0 110.27 -179.543 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 69.01 129.03 0.05 OUTLIER Glycine 0 CA--C 1.524 0.636 0 N-CA-C 111.159 -0.777 . . . . 0.0 111.159 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 2.2 pp -156.96 141.32 16.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.9 0.381 . . . . 0.0 110.522 179.739 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 25.8 t -164.04 41.59 0.09 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.456 -179.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 52.9 p-10 -82.38 169.79 16.05 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.472 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 88.8 mtm180 -75.46 149.66 38.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.651 -179.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 69.0 m-70 -45.18 150.45 0.79 Allowed Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.628 -179.544 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -66.34 -24.15 50.67 Favored 'Trans proline' 0 N--CA 1.495 1.57 0 C-N-CA 122.611 2.207 . . . . 0.0 112.096 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 48.5 t 47.25 -107.21 0.17 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.584 -179.646 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . 49.28 -161.37 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.586 -179.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.766 0 CA-C-O 118.063 -1.409 . . . . 0.0 110.922 179.965 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.272 0 N-CA-C 109.505 -1.438 . . . . 0.0 109.505 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 4.6 p80 -151.56 160.63 43.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.842 0.353 . . . . 0.0 110.54 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 123' ' ' GLY . . . . . . . . . . . . . . . 57.01 101.62 0.01 OUTLIER Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.986 -0.846 . . . . 0.0 110.986 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 12.2 p -62.04 -32.49 54.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.024 0.44 . . . . 0.0 110.716 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 125' ' ' GLU . . . . . . . . . . . . . 94.8 mt-10 -60.53 -171.7 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.798 179.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -176.93 178.14 48.16 Favored Glycine 0 CA--C 1.523 0.586 0 N-CA-C 110.975 -0.85 . . . . 0.0 110.975 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 127' ' ' ARG . . . . . . . . . . . . . 89.6 mtm180 -82.21 58.06 3.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.823 0.344 . . . . 0.0 110.571 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 128' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 -62.7 -42.32 99.58 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.573 -179.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 129' ' ' ARG . . . . . 0.742 ' H ' ' HE ' ' B' ' 129' ' ' ARG . 2.8 mmp_? 41.07 59.43 8.4 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.607 179.93 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -71.37 14.81 0.36 Allowed 'Trans proline' 0 C--N 1.308 -1.58 0 C-N-CA 122.661 2.241 . . . . 0.0 112.123 -179.589 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 131' ' ' SER . . . . . 0.463 ' H ' ' C ' ' B' ' 129' ' ' ARG . 83.2 p -116.71 5.62 13.18 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.883 -179.832 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 132' ' ' ALA . . . . . 0.619 ' N ' ' CD ' ' B' ' 133' ' ' PRO . . . -72.79 -41.86 7.39 Favored Pre-proline 0 C--N 1.322 -0.624 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.575 179.255 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 133' ' ' PRO . . . . . 0.619 ' CD ' ' N ' ' B' ' 132' ' ' ALA . 32.0 Cg_exo -57.44 140.76 94.15 Favored 'Trans proline' 0 C--N 1.311 -1.436 0 C-N-CA 122.678 2.252 . . . . 0.0 111.631 -179.046 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . 0.511 ' O ' ' N ' ' B' ' 136' ' ' SER . 0.1 OUTLIER -106.46 -71.53 0.75 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.072 -179.997 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 135' ' ' ASP . . . . . 0.43 ' C ' ' O ' ' B' ' 134' ' ' LEU . 98.0 m-20 -34.68 -30.94 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.19 0 O-C-N 123.48 0.488 . . . . 0.0 110.591 -179.231 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 136' ' ' SER . . . . . 0.511 ' N ' ' O ' ' B' ' 134' ' ' LEU . 83.4 p -44.51 -50.89 9.28 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.231 179.303 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -63.48 -44.01 95.65 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.235 179.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 138' ' ' ALA . . . . . . . . . . . . . . . -57.73 -29.35 64.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.383 179.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -72.62 -50.33 26.02 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 121.106 0.479 . . . . 0.0 110.222 179.497 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -65.01 -40.94 95.64 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.724 179.67 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 66.1 tp60 -65.19 -53.59 42.35 Favored 'General case' 0 C--O 1.241 0.62 0 CA-C-O 121.272 0.558 . . . . 0.0 110.761 -179.298 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 142' ' ' VAL . . . . . . . . . . . . . 92.6 t -62.97 -46.47 96.24 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.881 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -52.25 -43.67 64.48 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.229 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 51.0 m -59.88 -44.2 94.32 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.4 179.797 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 22.8 m -63.08 -51.76 65.37 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 120.493 -0.483 . . . . 0.0 111.065 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 146' ' ' LEU . . . . . 0.453 ' N ' ' CD1' ' B' ' 146' ' ' LEU . 7.7 mp -66.82 -19.79 65.81 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.667 179.761 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 147' ' ' GLN . . . . . . . . . . . . . 57.8 tt0 -74.38 -61.01 2.01 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.62 179.548 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -56.58 -51.63 67.9 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.631 -179.524 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.403 ' O ' ' C ' ' B' ' 150' ' ' ALA . 97.1 mt -55.2 -39.97 70.24 Favored 'General case' 0 CA--C 1.515 -0.386 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.307 -179.105 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 150' ' ' ALA . . . . . 0.558 ' O ' ' C ' ' B' ' 151' ' ' THR . . . -40.18 -73.94 0.04 OUTLIER 'General case' 0 CA--C 1.513 -0.464 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.262 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 151' ' ' THR . . . . . 0.558 ' C ' ' O ' ' B' ' 150' ' ' ALA . 92.4 m -2.24 106.87 0.03 OUTLIER Pre-proline 0 CA--C 1.539 0.528 0 O-C-N 124.627 1.204 . . . . 0.0 110.994 -179.333 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -43.72 -50.54 7.04 Favored 'Trans proline' 0 C--N 1.307 -1.638 0 C-N-CA 122.231 1.954 . . . . 0.0 112.977 -177.169 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 11.1 t -58.56 -46.32 87.13 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.985 -179.344 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 50.6 ttm-85 -63.68 -44.65 93.1 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 120.708 -0.397 . . . . 0.0 110.526 -179.497 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 155' ' ' LEU . . . . . 0.435 ' CD2' ' OG1' ' B' ' 159' ' ' THR . 1.6 tt -60.88 -51.41 69.42 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.543 -0.463 . . . . 0.0 110.464 -178.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 50.4 ttp -54.07 -47.53 71.59 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.583 -0.447 . . . . 0.0 110.942 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 90.5 mt -61.1 -47.51 93.24 Favored 'Isoleucine or valine' 0 C--O 1.239 0.526 0 CA-C-O 121.228 0.537 . . . . 0.0 110.58 -179.326 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -62.51 -41.16 98.66 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.654 179.467 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 159' ' ' THR . . . . . 0.435 ' OG1' ' CD2' ' B' ' 155' ' ' LEU . 18.6 m -59.37 -40.11 85.43 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.813 179.718 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 56.4 tp60 -61.6 -45.23 94.98 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.061 0.458 . . . . 0.0 109.921 -179.71 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 161' ' ' LEU . . . . . 0.438 ' O ' ' N ' ' B' ' 163' ' ' ASN . 9.5 mt -66.39 -23.84 66.39 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.96 179.702 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 162' ' ' ARG . . . . . 0.436 ' C ' ' O ' ' B' ' 161' ' ' LEU . 72.1 ttp85 -34.05 -35.54 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 O-C-N 123.533 0.521 . . . . 0.0 111.114 -179.214 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 163' ' ' ASN . . . . . 0.438 ' N ' ' O ' ' B' ' 161' ' ' LEU . 58.8 t-20 -61.77 -71.41 0.15 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.26 179.382 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 164' ' ' GLY . . . . . 0.409 ' H ' ' CD1' ' B' ' 166' ' ' LEU . . . 153.36 -76.33 0.22 Allowed Glycine 0 CA--C 1.527 0.822 0 N-CA-C 111.157 -0.777 . . . . 0.0 111.157 179.545 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 165' ' ' PRO . . . . . 0.422 ' C ' ' CD1' ' B' ' 166' ' ' LEU . 74.3 Cg_endo -82.08 101.74 1.16 Allowed 'Trans proline' 0 N--CA 1.492 1.391 0 C-N-CA 122.605 2.203 . . . . 0.0 112.182 179.174 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 166' ' ' LEU . . . . . 0.422 ' CD1' ' C ' ' B' ' 165' ' ' PRO . 5.3 mp -146.61 69.76 12.44 Favored Pre-proline 0 N--CA 1.464 0.246 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.397 179.666 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_exo -45.57 163.09 0.09 OUTLIER 'Trans proline' 0 C--N 1.307 -1.614 0 C-N-CA 122.52 2.147 . . . . 0.0 112.049 179.431 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . 87.6 t -53.85 -46.79 64.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 121.099 0.476 . . . . 0.0 110.402 -179.195 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 169' ' ' THR . . . . . . . . . . . . . 64.2 p -63.94 -35.46 80.74 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.472 179.374 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -66.79 -40.14 88.02 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.095 179.621 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 16.5 mt -63.12 -40.55 97.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.137 179.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 172' ' ' ALA . . . . . 0.577 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -59.06 -47.86 83.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.487 179.48 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 42.3 tp10 -57.02 -45.93 82.74 Favored 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 120.46 -0.496 . . . . 0.0 110.029 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -63.31 -49.72 72.89 Favored 'General case' 0 C--O 1.231 0.103 0 C-N-CA 120.669 -0.412 . . . . 0.0 110.717 -179.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 175' ' ' ILE . . . . . 0.431 HG22 HD13 ' B' ' 175' ' ' ILE . 96.3 mt -82.62 -71.16 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.432 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 176' ' ' GLY . . . . . 0.577 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 129.8 74.25 0.14 Allowed Glycine 0 N--CA 1.463 0.476 0 N-CA-C 111.205 -0.758 . . . . 0.0 111.205 179.419 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 177' ' ' MET . . . . . 0.421 ' CB ' ' O ' ' B' ' 176' ' ' GLY . 3.4 tmm? 75.43 102.08 0.07 Allowed 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 120.668 -0.413 . . . . 0.0 110.879 179.407 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 179.26 18.08 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.335 179.679 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 12.1 mt-30 -52.5 -32.01 38.1 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.651 -179.299 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 47.0 m -66.4 -43.44 85.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.921 0.391 . . . . 0.0 110.903 179.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -63.92 -30.77 71.83 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.365 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 94.5 t -72.78 -52.86 20.83 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.244 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.777 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 74.3 m -56.49 -45.49 80.95 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.456 -179.48 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 58.6 m-70 -62.22 -48.91 77.89 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.111 0.481 . . . . 0.0 110.661 179.789 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -62.9 -39.72 95.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.262 -179.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 5.4 tt -61.05 -43.31 99.07 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.559 -179.722 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -61.81 -42.36 98.92 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 120.979 -0.288 . . . . 0.0 110.687 179.712 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 99.4 t -64.18 -54.89 25.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 C-N-CA 120.158 -0.617 . . . . 0.0 110.691 -179.663 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 10.6 mp -61.75 -41.08 97.2 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.81 0.338 . . . . 0.0 110.164 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 79.5 ttt-85 -54.91 -42.52 72.3 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.156 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -57.82 -50.48 73.13 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.504 -0.478 . . . . 0.0 110.335 -179.683 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 192' ' ' LEU . . . . . 0.501 ' CD2' ' N ' ' B' ' 192' ' ' LEU . 3.9 mm? -66.76 -42.91 85.4 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.851 0.358 . . . . 0.0 110.853 179.496 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 105.77 42.14 1.74 Allowed Glycine 0 CA--C 1.525 0.717 0 N-CA-C 111.154 -0.778 . . . . 0.0 111.154 -179.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 194' ' ' LEU . . . . . 0.466 ' N ' ' CD1' ' B' ' 194' ' ' LEU . 8.1 mp -96.46 -15.1 21.92 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 120.496 0.189 . . . . 0.0 110.682 179.643 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 29.4 m -138.27 161.92 30.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.773 0.321 . . . . 0.0 110.269 -179.771 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 196' ' ' VAL . . . . . 0.429 ' CG1' ' N ' ' B' ' 197' ' ' GLY . 61.9 t -141.87 157.99 20.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.535 179.42 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 197' ' ' GLY . . . . . 0.429 ' N ' ' CG1' ' B' ' 196' ' ' VAL . . . -129.53 149.38 18.66 Favored Glycine 0 CA--C 1.521 0.447 0 N-CA-C 110.625 -0.99 . . . . 0.0 110.625 179.437 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -112.48 110.66 20.98 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-O 120.863 0.363 . . . . 0.0 110.709 -179.711 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 14.4 tpt180 -75.52 128.52 35.49 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.472 179.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 200' ' ' ALA . . . . . . . . . . . . . . . -142.14 95.22 2.77 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.531 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 201' ' ' GLY . . . . . . . . . . . . . . . 58.42 -113.05 4.48 Favored Glycine 0 CA--C 1.524 0.599 0 N-CA-C 110.627 -0.989 . . . . 0.0 110.627 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 202' ' ' ARG . . . . . . . . . . . . . 84.8 mtt85 -106.36 23.85 13.48 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.653 0.263 . . . . 0.0 110.577 179.696 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 8.2 t -138.97 130.78 27.64 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-O 120.899 0.38 . . . . 0.0 110.188 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 204' ' ' ILE . . . . . 0.406 HD11 ' N ' ' B' ' 205' ' ' VAL . 1.2 tp -121.46 128.03 75.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.901 179.429 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 205' ' ' VAL . . . . . 0.406 ' N ' HD11 ' B' ' 204' ' ' ILE . 70.7 t -104.41 130.61 54.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.033 -0.53 . . . . 0.0 109.77 178.63 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 77.0 m-85 -102.59 132.7 48.51 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.468 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 36.1 p -150.07 169.26 21.65 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.029 -179.413 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 208' ' ' LEU . . . . . 0.529 ' N ' ' CD1' ' B' ' 208' ' ' LEU . 7.8 mp -68.78 149.18 49.29 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.566 -179.28 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 59.3 t80 -53.46 -43.81 68.42 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.547 179.709 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 40.7 p30 -144.47 179.9 6.97 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.42 -179.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 25.4 m -96.16 -17.8 20.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.596 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 212' ' ' HIS . . . . . 0.504 ' CG ' ' HD1' ' A' ' 104' ' ' HIS . 89.4 m-70 -40.77 -65.82 0.38 Allowed 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 121.38 0.61 . . . . 0.0 110.706 179.674 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 7.5 p -47.57 -34.45 3.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.345 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 214' ' ' ALA . . . . . . . . . . . . . . . -65.45 -38.25 89.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.08 179.491 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -60.89 -45.57 94.1 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.032 -179.772 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 216' ' ' LEU . . . . . 0.495 ' CD1' ' N ' ' B' ' 216' ' ' LEU . 8.2 mp -61.09 -43.72 98.45 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.445 -0.502 . . . . 0.0 109.712 -179.579 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 7.1 tp -64.47 -40.21 95.27 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.461 179.309 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 65.7 t0 -56.44 -46.31 80.35 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.028 -179.49 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 219' ' ' GLU . . . . . . . . . . . . . 16.7 tp10 -70.13 -48.94 55.36 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.146 179.724 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -53.22 -47.53 68.89 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.331 179.584 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 4.5 mm -62.99 -44.6 99.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.597 -179.71 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 90.0 t80 -60.02 -42.82 95.18 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.985 -179.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 223' ' ' HIS . . . . . 0.478 ' HD1' ' CG ' ' A' ' 93' ' ' HIS . 47.8 t60 -68.41 -38.69 81.48 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.619 179.247 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 224' ' ' SER . . . . . 0.491 ' O ' ' N ' ' B' ' 228' ' ' HIS . 11.5 t -57.41 -48.78 78.19 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.648 -178.827 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 225' ' ' GLU . . . . . 0.489 ' C ' ' H ' ' B' ' 227' ' ' LEU . 96.0 mt-10 -77.14 -53.19 8.07 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.958 0.408 . . . . 0.0 111.428 179.111 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 86.2 t60 -49.05 -13.51 0.06 Allowed 'General case' 0 CA--C 1.518 -0.261 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.274 -178.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 227' ' ' LEU . . . . . 0.489 ' H ' ' C ' ' B' ' 225' ' ' GLU . 61.8 mt -142.72 -72.87 0.3 Allowed 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.9 179.917 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 228' ' ' HIS . . . . . 0.491 ' N ' ' O ' ' B' ' 224' ' ' SER . 20.3 t-80 75.97 74.57 0.09 Allowed 'General case' 0 C--N 1.328 -0.337 0 O-C-N 123.506 0.504 . . . . 0.0 110.427 -179.762 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 229' ' ' LEU . . . . . 0.423 ' N ' ' CD1' ' B' ' 229' ' ' LEU . 10.5 mp -62.9 -42.37 99.76 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.498 -179.761 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . 69.37 131.31 0.06 OUTLIER Glycine 0 CA--C 1.525 0.712 0 N-CA-C 110.922 -0.871 . . . . 0.0 110.922 -179.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 231' ' ' LEU . . . . . . . . . . . . . 2.2 pp -159.68 140.25 12.15 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.814 0.34 . . . . 0.0 110.586 179.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 232' ' ' SER . . . . . . . . . . . . . 39.8 t -163.05 43.26 0.12 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.356 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 233' ' ' ASP . . . . . . . . . . . . . 54.3 p-10 -83.27 169.91 15.2 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.588 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 234' ' ' ARG . . . . . . . . . . . . . 88.1 mtm180 -76.6 150.02 36.51 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.692 -179.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 235' ' ' HIS . . . . . . . . . . . . . 69.9 m-70 -44.94 149.73 0.81 Allowed Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.69 -179.361 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 236' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -66.05 -22.48 54.83 Favored 'Trans proline' 0 N--CA 1.493 1.478 0 C-N-CA 122.697 2.264 . . . . 0.0 112.096 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 237' ' ' SER . . . . . . . . . . . . . 47.5 t 46.4 -108.25 0.18 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.585 -179.693 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 238' ' ' ALA . . . . . . . . . . . . . . . 49.56 -160.11 0.06 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.581 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.745 0 CA-C-O 118.041 -1.421 . . . . 0.0 110.918 179.978 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.428 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 61.5 m170 -63.03 -44.89 94.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.732 0.301 . . . . 0.0 110.433 -179.813 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -83.15 -128.62 1.34 Allowed Glycine 0 CA--C 1.521 0.467 0 N-CA-C 110.69 -0.964 . . . . 0.0 110.69 179.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 33.9 m -127.88 132.85 68.4 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-O 120.777 0.322 . . . . 0.0 110.445 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 45.1 tt0 -89.73 124.32 34.52 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.367 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -88.34 118.29 5.05 Favored Glycine 0 CA--C 1.524 0.641 0 N-CA-C 110.756 -0.938 . . . . 0.0 110.756 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 88.6 mtm180 -78.64 144.08 35.76 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.678 0.275 . . . . 0.0 110.496 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.479 ' C ' ' HE ' ' A' ' 10' ' ' ARG . 18.7 p30 -81.59 133.89 35.43 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.561 -179.981 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.479 ' HE ' ' C ' ' A' ' 9' ' ' ASN . 0.0 OUTLIER -73.46 151.71 89.66 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.658 -179.495 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -67.98 154.75 71.96 Favored 'Trans proline' 0 C--N 1.309 -1.535 0 C-N-CA 122.722 2.281 . . . . 0.0 111.995 179.444 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 7.1 m -52.62 106.15 0.15 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.444 179.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -165.67 60.65 0.68 Allowed Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.432 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -72.83 41.38 0.54 Allowed 'Trans proline' 0 C--N 1.309 -1.549 0 C-N-CA 122.785 2.323 . . . . 0.0 111.938 -179.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.552 ' O ' ' N ' ' A' ' 17' ' ' SER . 71.0 mt -74.86 141.99 44.17 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.269 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.406 ' C ' ' O ' ' A' ' 15' ' ' LEU . 97.7 m-20 -35.64 -26.86 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.27 0 O-C-N 123.467 0.48 . . . . 0.0 110.645 -179.822 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.552 ' N ' ' O ' ' A' ' 15' ' ' LEU . 11.4 t -56.43 -48.16 77.55 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-O 121.362 0.601 . . . . 0.0 109.723 179.338 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.439 ' N ' ' O ' ' A' ' 15' ' ' LEU . 90.7 mm-40 -65.3 -47.48 76.45 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.02 179.42 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -56.31 -29.12 60.82 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.237 -179.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -71.28 -49.71 40.2 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 120.867 -0.333 . . . . 0.0 110.152 179.554 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.25 -44.01 95.62 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.525 179.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -59.4 -49.36 78.09 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-O 121.162 0.506 . . . . 0.0 110.352 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.468 ' O ' ' OG1' ' A' ' 26' ' ' THR . 84.4 t -61.71 -44.26 98.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.025 179.626 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.78 -41.9 82.99 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 120.876 0.37 . . . . 0.0 110.032 179.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 48.3 t -58.76 -44.84 90.69 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.021 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.468 ' OG1' ' O ' ' A' ' 23' ' ' VAL . 71.3 p -64.42 -47.28 79.73 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 120.989 0.423 . . . . 0.0 110.566 179.362 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 95.1 mt -63.95 -23.77 67.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.406 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 54.9 tt0 -75.65 -56.49 4.64 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.733 179.542 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.65 -55.1 39.38 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.786 -179.333 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.478 ' O ' ' O ' ' A' ' 31' ' ' ALA . 3.8 mm? -46.8 -35.14 5.92 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 -179.18 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.478 ' O ' ' O ' ' A' ' 30' ' ' LEU . . . -55.07 -161.92 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.064 -0.517 . . . . 0.0 109.858 179.428 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.531 ' CB ' HH11 ' A' ' 35' ' ' ARG . 1.0 OUTLIER 81.86 114.41 0.03 OUTLIER Pre-proline 0 C--N 1.323 -0.544 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.182 179.827 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -49.19 -42.6 39.34 Favored 'Trans proline' 0 N--CA 1.496 1.641 0 C-N-CA 122.265 1.977 . . . . 0.0 112.957 -179.14 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 47.4 t -59.36 -45.54 91.11 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.881 -179.191 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.531 HH11 ' CB ' ' A' ' 32' ' ' THR . 84.6 mtt85 -62.03 -44.31 96.98 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.738 -0.385 . . . . 0.0 111.186 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -61.3 -47.59 85.27 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.476 -0.49 . . . . 0.0 110.96 -179.52 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.435 ' O ' ' OE1' ' A' ' 41' ' ' GLN . 20.2 ttm -56.54 -48.95 76.19 Favored 'General case' 0 C--N 1.319 -0.743 0 C-N-CA 120.285 -0.566 . . . . 0.0 110.301 -179.804 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.415 HG23 HD13 ' A' ' 38' ' ' ILE . 37.8 mm -63.5 -43.66 98.45 Favored 'Isoleucine or valine' 0 C--O 1.234 0.256 0 CA-C-O 121.045 0.45 . . . . 0.0 110.44 -179.752 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 mt -62.15 -39.75 93.66 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.456 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 18.0 m -60.55 -43.72 96.9 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.101 -0.5 . . . . 0.0 109.981 179.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.435 ' OE1' ' O ' ' A' ' 37' ' ' MET . 3.4 mp0 -61.31 -44.9 96.44 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.985 0.422 . . . . 0.0 110.041 179.809 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 97.9 mt -61.79 -40.23 94.47 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.066 -179.434 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.536 ' NH2' ' OD2' ' A' ' 99' ' ' ASP . 20.3 tpt180 -63.72 -37.67 88.21 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.951 179.974 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -56.95 -42.33 79.91 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.692 -178.54 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 169.38 -174.49 43.77 Favored Glycine 0 CA--C 1.527 0.786 0 N-CA-C 111.007 -0.837 . . . . 0.0 111.007 179.724 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -77.83 122.34 5.83 Favored 'Trans proline' 0 C--N 1.311 -1.408 0 C-N-CA 122.819 2.346 . . . . 0.0 111.663 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -150.16 95.89 3.55 Favored Pre-proline 0 CA--C 1.537 0.451 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.961 -179.248 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_exo -47.06 173.22 0.03 OUTLIER 'Trans proline' 0 C--N 1.306 -1.664 0 C-N-CA 122.495 2.13 . . . . 0.0 112.284 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 73.0 t -54.64 -45.02 72.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.433 -179.23 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 15.3 m -59.78 -40.24 87.62 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.22 0.533 . . . . 0.0 110.255 179.208 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 56.3 t0 -65.71 -38.98 90.68 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.16 179.517 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.46 -44.19 97.0 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-O 121.308 0.575 . . . . 0.0 110.028 -179.565 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.497 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -55.87 -48.44 75.57 Favored 'General case' 0 N--CA 1.444 -0.738 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 179.707 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 44.9 tp10 -56.48 -48.43 77.14 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.318 -0.553 . . . . 0.0 110.549 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -54.29 -58.07 8.8 Favored 'General case' 0 C--N 1.332 -0.163 0 C-N-CA 120.896 -0.322 . . . . 0.0 110.614 -179.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 90.6 mt -86.35 -73.16 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.417 179.775 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . 0.497 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 131.88 98.09 0.72 Allowed Glycine 0 N--CA 1.461 0.316 0 N-CA-C 111.055 -0.818 . . . . 0.0 111.055 -179.679 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 64.3 mtt 66.48 99.54 0.05 OUTLIER 'General case' 0 C--N 1.34 0.18 0 CA-C-O 120.767 0.317 . . . . 0.0 110.722 178.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -179.53 15.12 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.359 179.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 -55.54 -36.9 67.29 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.549 -179.372 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.596 ' HG ' ' H ' ' A' ' 62' ' ' ALA . 78.1 p -62.09 -49.29 76.53 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.821 -179.719 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.596 ' H ' ' HG ' ' A' ' 61' ' ' SER . . . -58.34 -35.87 72.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.278 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 75.8 t -67.19 -52.95 37.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.596 -179.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 10.4 t -56.84 -42.29 79.38 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.248 -179.416 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -63.17 -49.8 72.88 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.816 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 86.6 mm-40 -63.72 -41.17 98.12 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.594 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.8 tp -62.52 -44.66 95.82 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.359 -179.679 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 70.4 mmt-85 -62.43 -42.42 99.44 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.848 0.356 . . . . 0.0 110.66 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 71.9 t -67.23 -54.37 24.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 C-N-CA 120.262 -0.575 . . . . 0.0 110.468 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 92.4 mt -58.49 -41.4 85.24 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.063 -179.323 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 73.5 ttt180 -58.55 -41.67 86.14 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.405 179.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 93.3 m-20 -57.65 -50.39 73.32 Favored 'General case' 0 C--N 1.332 -0.171 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.455 -179.421 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.8 mt -67.7 -40.76 84.3 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.934 0.397 . . . . 0.0 110.407 -179.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 103.09 78.76 1.31 Allowed Glycine 0 CA--C 1.52 0.398 0 N-CA-C 110.872 -0.891 . . . . 0.0 110.872 -179.644 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 6.7 tp -144.9 -9.35 0.61 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.943 0.401 . . . . 0.0 110.793 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 33.8 m -139.05 158.34 29.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.454 -179.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.435 ' O ' ' O ' ' A' ' 88' ' ' SER . 48.4 t -143.99 157.69 15.87 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.577 -179.793 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -134.44 144.48 16.45 Favored Glycine 0 CA--C 1.521 0.463 0 N-CA-C 110.388 -1.085 . . . . 0.0 110.388 179.623 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 46.9 t0 -103.51 106.54 17.08 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 120.919 0.39 . . . . 0.0 110.343 179.519 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -80.9 132.46 35.44 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.674 179.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.616 ' C ' ' H ' ' A' ' 83' ' ' ARG . . . -131.13 147.68 52.64 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.352 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -65.59 33.92 0.13 Allowed Glycine 0 CA--C 1.527 0.82 0 N-CA-C 111.16 -0.776 . . . . 0.0 111.16 -179.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.616 ' H ' ' C ' ' A' ' 81' ' ' ALA . 8.3 ptp85 -157.26 -26.05 0.09 Allowed 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 120.687 0.279 . . . . 0.0 110.261 179.965 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' SER . . . . . 0.42 ' OG ' ' O ' ' A' ' 83' ' ' ARG . 18.5 m -173.91 167.43 4.33 Favored 'General case' 0 CA--C 1.518 -0.287 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 -179.727 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -122.41 130.03 74.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.901 179.262 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 46.6 t -109.16 133.12 55.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.218 178.855 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -106.88 131.47 53.93 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.288 179.749 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.435 ' O ' ' O ' ' A' ' 77' ' ' VAL . 99.9 p -150.09 166.88 28.42 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.487 ' O ' ' N ' ' A' ' 91' ' ' ASP . 0.3 OUTLIER -78.9 154.16 29.93 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.175 -179.361 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.566 ' CD2' ' OG1' ' A' ' 92' ' ' THR . 71.0 t80 -46.17 -15.55 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.434 179.688 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.487 ' N ' ' O ' ' A' ' 89' ' ' LEU . 52.8 t0 41.94 89.81 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.189 179.055 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' THR . . . . . 0.566 ' OG1' ' CD2' ' A' ' 90' ' ' TYR . 2.1 m -169.58 -133.8 0.02 OUTLIER 'General case' 0 C--O 1.236 0.353 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.56 179.656 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . 0.423 ' H ' ' CG2' ' A' ' 92' ' ' THR . 40.4 m80 -55.08 -53.06 60.65 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.021 -179.89 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 95.3 t -49.78 -39.53 14.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.245 179.754 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.52 -41.44 98.86 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.485 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 58.6 tt0 -60.65 -46.34 90.71 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.006 0.432 . . . . 0.0 110.11 -179.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.498 HD13 ' N ' ' B' ' 220' ' ' ALA . 3.7 mm? -62.32 -43.14 99.52 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.433 179.677 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 62.3 tp -65.06 -39.29 93.07 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.422 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . 0.536 ' OD2' ' NH2' ' A' ' 43' ' ' ARG . 94.2 m-20 -62.71 -39.84 95.27 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.154 0.502 . . . . 0.0 110.839 -178.983 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.464 ' OE2' ' OE2' ' B' ' 219' ' ' GLU . 97.5 mt-10 -74.16 -52.62 11.93 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.825 179.67 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . 0.484 ' N ' HD13 ' B' ' 216' ' ' LEU . . . -57.89 -48.37 80.06 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.965 -179.629 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . 0.538 ' CG2' ' N ' ' A' ' 103' ' ' TYR . 10.4 tp -64.73 -46.1 93.2 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 CA-C-O 120.892 0.377 . . . . 0.0 111.111 -179.096 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' TYR . . . . . 0.538 ' N ' ' CG2' ' A' ' 102' ' ' ILE . 91.0 t80 -62.98 -43.97 97.31 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.783 -179.422 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 3.4 m-70 -67.31 -41.44 85.32 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.756 -179.734 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 6.4 t -67.93 -44.29 77.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.977 0.417 . . . . 0.0 110.744 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 15.1 tm-20 -67.63 -29.2 68.46 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.569 -179.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . 0.535 ' O ' ' N ' ' A' ' 109' ' ' HIS . 18.7 t60 -51.37 -67.85 0.22 Allowed 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.262 -178.946 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.429 ' CD2' ' N ' ' A' ' 108' ' ' LEU . 4.4 mm? -41.3 91.11 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.027 0.441 . . . . 0.0 110.401 -179.779 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . 0.535 ' N ' ' O ' ' A' ' 107' ' ' HIS . 82.5 t60 -107.75 125.19 51.11 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.567 179.847 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.489 ' CD1' ' N ' ' A' ' 110' ' ' LEU . 9.3 mp -62.33 -42.75 99.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.295 -179.382 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . 0.411 ' O ' ' O ' ' A' ' 110' ' ' LEU . . . 57.9 114.6 0.01 OUTLIER Glycine 0 CA--C 1.526 0.727 0 N-CA-C 110.775 -0.93 . . . . 0.0 110.775 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.489 ' CD1' ' N ' ' A' ' 112' ' ' LEU . 8.8 mp 54.71 41.54 31.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.768 0.318 . . . . 0.0 110.418 179.901 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 14.9 m 51.76 -96.63 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.405 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 42.4 p30 -153.88 -173.58 4.63 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.709 -179.735 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 79.3 mtp85 -62.15 -39.86 94.04 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.201 -179.829 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 3.1 m-70 -62.05 149.89 85.07 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.607 -179.651 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -66.63 128.52 19.22 Favored 'Trans proline' 0 N--CA 1.494 1.522 0 C-N-CA 122.511 2.141 . . . . 0.0 111.995 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 43.0 t -63.08 -44.1 96.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.555 179.483 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -167.4 154.53 8.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.639 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.671 0 CA-C-O 118.052 -1.416 . . . . 0.0 110.963 179.896 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.172 0 N-CA-C 109.579 -1.408 . . . . 0.0 109.579 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 54.7 m170 -61.31 -45.2 95.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.728 0.299 . . . . 0.0 110.609 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 123' ' ' GLY . . . . . . . . . . . . . . . -85.83 -118.18 0.97 Allowed Glycine 0 CA--C 1.523 0.532 0 N-CA-C 110.62 -0.992 . . . . 0.0 110.62 179.783 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 20.5 m -132.46 151.25 34.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 120.802 0.335 . . . . 0.0 110.326 179.682 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 125' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -108.43 120.4 42.28 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.456 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -82.95 117.65 4.45 Favored Glycine 0 CA--C 1.525 0.66 0 N-CA-C 110.723 -0.951 . . . . 0.0 110.723 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 127' ' ' ARG . . . . . . . . . . . . . 89.9 mtm180 -80.09 139.33 36.92 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.775 0.321 . . . . 0.0 110.519 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 128' ' ' ASN . . . . . 0.531 ' C ' ' HE ' ' B' ' 129' ' ' ARG . 22.0 p30 -75.9 134.2 40.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.586 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 129' ' ' ARG . . . . . 0.531 ' HE ' ' C ' ' B' ' 128' ' ' ASN . 0.0 OUTLIER -75.19 151.67 85.91 Favored Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.495 -179.603 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -67.57 152.98 77.59 Favored 'Trans proline' 0 N--CA 1.494 1.516 0 C-N-CA 122.642 2.228 . . . . 0.0 112.107 179.432 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 33.3 m -50.82 103.21 0.05 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.347 179.806 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 132' ' ' ALA . . . . . 0.402 ' C ' ' H ' ' B' ' 134' ' ' LEU . . . -161.52 58.26 0.91 Allowed Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.502 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 133' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -71.45 41.79 0.44 Allowed 'Trans proline' 0 N--CA 1.494 1.555 0 C-N-CA 122.823 2.348 . . . . 0.0 111.926 -179.81 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . 0.557 ' O ' ' N ' ' B' ' 136' ' ' SER . 61.0 mt -76.57 142.67 40.69 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.283 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 135' ' ' ASP . . . . . 0.408 ' C ' ' O ' ' B' ' 134' ' ' LEU . 98.9 m-20 -34.97 -28.01 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.255 0 O-C-N 123.496 0.497 . . . . 0.0 110.639 -179.851 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 136' ' ' SER . . . . . 0.557 ' N ' ' O ' ' B' ' 134' ' ' LEU . 9.9 t -55.15 -48.68 73.38 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.236 0.541 . . . . 0.0 109.788 179.514 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 137' ' ' GLN . . . . . 0.414 ' N ' ' O ' ' B' ' 134' ' ' LEU . 95.6 mm-40 -65.36 -47.6 75.88 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.937 179.535 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 138' ' ' ALA . . . . . . . . . . . . . . . -56.02 -29.81 60.93 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.196 -179.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -71.28 -49.88 38.34 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 120.888 0.375 . . . . 0.0 110.156 179.653 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -61.1 -41.14 96.12 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.529 179.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -61.21 -49.86 75.45 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-O 121.214 0.531 . . . . 0.0 110.427 179.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 142' ' ' VAL . . . . . 0.474 ' O ' ' OG1' ' B' ' 145' ' ' THR . 93.5 t -61.78 -44.46 98.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.145 179.697 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -57.01 -42.19 79.88 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 120.804 0.335 . . . . 0.0 110.167 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 14.0 t -58.71 -44.97 90.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.98 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 145' ' ' THR . . . . . 0.474 ' OG1' ' O ' ' B' ' 142' ' ' VAL . 77.5 p -64.2 -46.36 84.27 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 120.967 0.413 . . . . 0.0 110.451 179.466 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 95.4 mt -64.51 -23.4 67.26 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.435 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 147' ' ' GLN . . . . . . . . . . . . . 57.1 tt0 -75.64 -56.36 4.76 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.785 179.527 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -59.12 -55.2 38.03 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.766 -179.393 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.467 ' O ' ' O ' ' B' ' 150' ' ' ALA . 3.8 mm? -46.66 -36.38 6.99 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 -179.127 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 150' ' ' ALA . . . . . 0.479 ' O ' ' CB ' ' B' ' 151' ' ' THR . . . -54.86 -162.2 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.927 179.602 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 151' ' ' THR . . . . . 0.547 ' CB ' HH11 ' B' ' 154' ' ' ARG . 0.6 OUTLIER 82.79 115.07 0.03 OUTLIER Pre-proline 0 CA--C 1.54 0.564 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.294 179.694 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -48.98 -42.68 37.74 Favored 'Trans proline' 0 N--CA 1.496 1.618 0 C-N-CA 122.18 1.92 . . . . 0.0 113.063 -179.303 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 39.6 t -60.16 -45.97 91.28 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.976 -179.131 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 154' ' ' ARG . . . . . 0.547 HH11 ' CB ' ' B' ' 151' ' ' THR . 84.4 mtt85 -62.56 -43.6 98.41 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.125 -179.722 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 155' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -62.69 -47.0 85.52 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.72 -0.392 . . . . 0.0 111.036 -179.479 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 36.4 ttp -58.34 -48.92 79.01 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.266 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 35.3 mm -63.28 -43.84 98.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 121.054 0.454 . . . . 0.0 110.371 179.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 36.9 mt -61.5 -40.68 95.48 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.222 -179.709 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 19.9 m -59.97 -45.14 93.66 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.005 179.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -58.03 -45.1 87.5 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.676 -0.41 . . . . 0.0 109.991 179.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 161' ' ' LEU . . . . . . . . . . . . . 97.0 mt -62.03 -40.07 94.47 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.122 0.486 . . . . 0.0 109.996 -179.47 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 162' ' ' ARG . . . . . 0.548 ' NH2' ' OD2' ' B' ' 218' ' ' ASP . 21.5 tpt180 -63.52 -37.99 89.41 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.951 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 98.4 m-20 -56.57 -42.09 78.04 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.588 -178.64 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . 169.43 -175.91 43.56 Favored Glycine 0 CA--C 1.528 0.876 0 N-CA-C 110.997 -0.841 . . . . 0.0 110.997 179.665 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -76.99 123.26 6.66 Favored 'Trans proline' 0 N--CA 1.492 1.413 0 C-N-CA 122.856 2.371 . . . . 0.0 111.593 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -150.61 96.38 3.39 Favored Pre-proline 0 CA--C 1.538 0.504 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.016 -179.238 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_exo -47.06 173.31 0.03 OUTLIER 'Trans proline' 0 C--N 1.306 -1.71 0 C-N-CA 122.456 2.104 . . . . 0.0 112.309 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . 81.7 t -54.77 -45.2 73.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.43 -179.292 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 169' ' ' THR . . . . . . . . . . . . . 15.7 m -59.99 -40.28 88.61 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.186 0.517 . . . . 0.0 110.229 179.199 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -65.45 -38.64 90.45 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.191 179.297 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.63 -44.82 95.33 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.272 0.558 . . . . 0.0 110.011 -179.587 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 172' ' ' ALA . . . . . 0.486 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -55.66 -48.07 75.64 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 179.782 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 43.6 tp10 -56.04 -48.39 76.07 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.308 -0.557 . . . . 0.0 110.502 179.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -54.82 -58.35 7.93 Favored 'General case' 0 C--N 1.333 -0.136 0 C-N-CA 120.749 -0.38 . . . . 0.0 110.776 -179.511 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 87.7 mt -86.62 -72.98 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.454 179.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 176' ' ' GLY . . . . . 0.486 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 130.54 99.41 0.84 Allowed Glycine 0 N--CA 1.461 0.323 0 N-CA-C 111.119 -0.792 . . . . 0.0 111.119 -179.779 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 62.5 mtt 66.27 95.71 0.06 Allowed 'General case' 0 CA--C 1.521 -0.172 0 CA-C-O 120.887 0.375 . . . . 0.0 110.745 178.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -176.71 14.65 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.404 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 54.8 mt-30 -55.79 -37.07 68.11 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.64 -179.247 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 180' ' ' SER . . . . . 0.569 ' HG ' ' H ' ' B' ' 181' ' ' ALA . 64.3 p -61.49 -48.43 81.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.036 -179.726 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 181' ' ' ALA . . . . . 0.569 ' H ' ' HG ' ' B' ' 180' ' ' SER . . . -59.2 -35.4 73.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.233 -179.902 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 97.5 t -67.12 -52.91 38.38 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.101 0 C-N-CA 120.467 -0.493 . . . . 0.0 110.726 -179.713 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 10.7 t -57.11 -42.18 80.33 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.289 -179.576 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 86.0 t60 -63.42 -50.27 70.48 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.905 -179.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 90.6 mm-40 -63.69 -40.48 96.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.949 0.404 . . . . 0.0 110.668 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 8.6 tp -62.52 -44.94 95.13 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.403 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 73.1 mmt-85 -62.46 -42.31 99.38 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.746 -179.761 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 77.7 t -66.34 -54.58 24.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 C-N-CA 120.179 -0.608 . . . . 0.0 110.506 -179.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 87.2 mt -58.83 -41.15 86.19 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 -179.251 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 71.8 ttt180 -57.95 -41.37 82.69 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.272 179.704 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 -59.82 -49.87 76.03 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 120.488 -0.485 . . . . 0.0 110.447 -179.33 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 192' ' ' LEU . . . . . . . . . . . . . 9.2 mt -67.55 -39.41 84.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.816 0.341 . . . . 0.0 110.464 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 101.28 80.98 1.54 Allowed Glycine 0 N--CA 1.462 0.42 0 N-CA-C 110.727 -0.949 . . . . 0.0 110.727 -179.639 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 4.9 tp -147.47 -9.68 0.42 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.777 0.322 . . . . 0.0 110.768 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 26.7 m -140.05 159.18 26.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.412 -179.636 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 196' ' ' VAL . . . . . 0.443 ' O ' ' O ' ' B' ' 207' ' ' SER . 47.7 t -145.62 159.62 12.46 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.493 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 197' ' ' GLY . . . . . . . . . . . . . . . -135.68 145.21 17.22 Favored Glycine 0 CA--C 1.523 0.563 0 N-CA-C 110.409 -1.077 . . . . 0.0 110.409 179.615 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 67.3 t0 -103.21 106.21 16.67 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 120.868 0.366 . . . . 0.0 110.337 179.564 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 3.4 tmt_? -80.57 134.81 35.97 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.562 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 200' ' ' ALA . . . . . 0.612 ' C ' ' H ' ' B' ' 202' ' ' ARG . . . -133.25 148.42 51.98 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.407 -179.934 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 201' ' ' GLY . . . . . . . . . . . . . . . -65.38 31.08 0.12 Allowed Glycine 0 CA--C 1.524 0.655 0 N-CA-C 111.21 -0.756 . . . . 0.0 111.21 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 202' ' ' ARG . . . . . 0.612 ' H ' ' C ' ' B' ' 200' ' ' ALA . 8.1 ptp85 -153.08 -27.06 0.15 Allowed 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 110.246 -0.279 . . . . 0.0 110.246 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 203' ' ' SER . . . . . 0.446 ' OG ' ' O ' ' B' ' 202' ' ' ARG . 19.0 m -174.45 169.46 3.73 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 -179.633 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 1.3 tp -122.77 132.26 71.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.021 179.352 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 47.2 t -111.74 132.55 60.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.179 178.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 96.3 m-85 -106.07 131.97 52.7 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.417 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 207' ' ' SER . . . . . 0.443 ' O ' ' O ' ' B' ' 196' ' ' VAL . 40.6 p -150.52 167.26 27.72 Favored 'General case' 0 CA--C 1.52 -0.196 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 208' ' ' LEU . . . . . 0.473 ' C ' ' H ' ' B' ' 210' ' ' ASP . 0.3 OUTLIER -78.97 154.12 29.81 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.224 -179.158 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 209' ' ' TYR . . . . . 0.554 ' CD2' ' OG1' ' B' ' 211' ' ' THR . 66.4 t80 -46.36 -15.85 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.805 0.336 . . . . 0.0 110.529 179.647 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 210' ' ' ASP . . . . . 0.473 ' H ' ' C ' ' B' ' 208' ' ' LEU . 35.5 t0 42.45 89.72 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.21 179.107 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 211' ' ' THR . . . . . 0.554 ' OG1' ' CD2' ' B' ' 209' ' ' TYR . 2.3 m -169.32 -134.77 0.02 OUTLIER 'General case' 0 C--O 1.238 0.47 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.471 179.634 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 212' ' ' HIS . . . . . 0.451 ' H ' ' CG2' ' B' ' 211' ' ' THR . 40.4 m80 -55.36 -53.51 55.3 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.02 -179.904 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 92.9 t -48.9 -38.88 11.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.214 179.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 214' ' ' ALA . . . . . . . . . . . . . . . -63.26 -42.24 99.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.347 179.831 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 58.8 tt0 -58.78 -46.62 87.1 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.073 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 216' ' ' LEU . . . . . 0.484 HD13 ' N ' ' A' ' 101' ' ' ALA . 3.5 mm? -61.99 -42.69 99.42 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.441 179.647 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 58.1 tp -65.4 -39.97 92.83 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.509 179.75 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 218' ' ' ASP . . . . . 0.548 ' OD2' ' NH2' ' B' ' 162' ' ' ARG . 98.8 m-20 -62.46 -40.16 95.74 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.163 0.506 . . . . 0.0 110.975 -178.941 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 219' ' ' GLU . . . . . 0.464 ' OE2' ' OE2' ' A' ' 100' ' ' GLU . 97.0 mt-10 -74.36 -53.45 9.62 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.807 179.564 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 220' ' ' ALA . . . . . 0.498 ' N ' HD13 ' A' ' 97' ' ' LEU . . . -56.8 -48.75 77.25 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.852 -179.305 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 221' ' ' ILE . . . . . 0.525 ' CG2' ' N ' ' B' ' 222' ' ' TYR . 3.8 tp -64.94 -45.76 93.77 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 C-N-CA 120.571 -0.452 . . . . 0.0 111.11 -179.174 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 222' ' ' TYR . . . . . 0.525 ' N ' ' CG2' ' B' ' 221' ' ' ILE . 90.4 t80 -62.36 -43.75 98.09 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.547 -179.46 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 223' ' ' HIS . . . . . . . . . . . . . 2.9 m-70 -67.47 -41.45 84.58 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.7 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 6.2 t -68.02 -44.5 76.37 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.915 0.388 . . . . 0.0 110.834 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 15.3 tm-20 -67.81 -28.78 67.87 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.664 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 226' ' ' HIS . . . . . 0.516 ' O ' ' N ' ' B' ' 228' ' ' HIS . 15.7 t60 -51.26 -68.03 0.2 Allowed 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.263 -178.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 227' ' ' LEU . . . . . 0.433 ' CD2' ' N ' ' B' ' 227' ' ' LEU . 4.4 mm? -41.68 92.66 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.079 0.466 . . . . 0.0 110.386 -179.821 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 228' ' ' HIS . . . . . 0.516 ' N ' ' O ' ' B' ' 226' ' ' HIS . 85.4 t60 -108.5 125.3 51.64 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.599 179.765 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 229' ' ' LEU . . . . . 0.41 ' O ' ' O ' ' B' ' 230' ' ' GLY . 10.8 mp -61.81 -41.94 98.39 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.209 -179.602 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 230' ' ' GLY . . . . . 0.41 ' O ' ' O ' ' B' ' 229' ' ' LEU . . . 57.29 113.34 0.01 OUTLIER Glycine 0 CA--C 1.524 0.646 0 N-CA-C 110.899 -0.88 . . . . 0.0 110.899 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 231' ' ' LEU . . . . . 0.495 ' N ' ' CD1' ' B' ' 231' ' ' LEU . 8.7 mp 54.92 41.76 31.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.805 0.336 . . . . 0.0 110.485 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 232' ' ' SER . . . . . . . . . . . . . 30.8 m 52.41 -98.77 0.07 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.558 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 233' ' ' ASP . . . . . . . . . . . . . 50.2 p30 -152.35 -174.93 5.06 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.583 -179.752 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 234' ' ' ARG . . . . . . . . . . . . . 79.0 mtp85 -60.43 -41.67 94.5 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.422 -179.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 235' ' ' HIS . . . . . . . . . . . . . 2.6 m-70 -60.5 150.27 74.67 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.761 -179.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 236' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -66.86 128.59 19.1 Favored 'Trans proline' 0 N--CA 1.494 1.516 0 C-N-CA 122.52 2.146 . . . . 0.0 112.038 179.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 237' ' ' SER . . . . . . . . . . . . . 42.0 t -63.37 -44.07 95.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.516 179.653 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 238' ' ' ALA . . . . . . . . . . . . . . . -166.97 154.15 8.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.536 -179.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.72 0 CA-C-O 118.041 -1.422 . . . . 0.0 110.937 179.897 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.261 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.413 ' O ' ' ND1' ' A' ' 3' ' ' HIS . 49.7 t-80 47.91 41.54 14.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.817 0.341 . . . . 0.0 110.538 -179.979 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -176.7 -178.57 46.56 Favored Glycine 0 CA--C 1.521 0.442 0 N-CA-C 110.815 -0.914 . . . . 0.0 110.815 179.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 33.7 m -120.83 131.02 73.95 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 CA-C-O 120.853 0.359 . . . . 0.0 110.57 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 72.8 mm-40 -61.59 -64.81 0.82 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.55 -179.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 146.0 149.28 4.96 Favored Glycine 0 CA--C 1.524 0.611 0 N-CA-C 110.894 -0.882 . . . . 0.0 110.894 179.774 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 84.6 mtt85 -64.92 -41.32 95.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.86 0.362 . . . . 0.0 110.636 179.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 90.8 m-20 52.83 56.72 7.2 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.689 179.74 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 85.8 mtm180 -68.64 147.93 98.03 Favored Pre-proline 0 N--CA 1.452 -0.357 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.755 -179.464 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -70.54 146.57 55.74 Favored 'Trans proline' 0 C--N 1.309 -1.522 0 C-N-CA 122.698 2.265 . . . . 0.0 111.956 179.583 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 40.7 t -106.58 95.76 5.97 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.481 179.472 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -168.35 149.41 4.59 Favored Pre-proline 0 N--CA 1.45 -0.473 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.813 179.609 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -66.89 143.48 66.74 Favored 'Trans proline' 0 C--N 1.31 -1.453 0 C-N-CA 122.784 2.322 . . . . 0.0 111.736 179.594 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.664 ' H ' ' CD2' ' A' ' 15' ' ' LEU . 1.1 pt? -105.48 2.27 28.38 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.72 179.635 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.454 ' C ' ' O ' ' A' ' 15' ' ' LEU . 22.8 p-10 -33.48 -45.43 0.16 Allowed 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.948 0.404 . . . . 0.0 110.673 -179.121 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 78.3 p -54.74 -49.69 70.19 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.299 178.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.534 ' N ' ' O ' ' A' ' 15' ' ' LEU . 11.1 tp-100 -62.44 -45.1 94.59 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.308 -0.405 . . . . 0.0 109.909 179.808 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -57.14 -29.41 63.56 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.377 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -72.72 -51.73 18.04 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 121.201 0.524 . . . . 0.0 110.416 179.547 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.2 -41.08 97.23 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.954 179.76 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 59.4 tt0 -64.92 -53.3 48.68 Favored 'General case' 0 C--O 1.241 0.654 0 CA-C-O 121.279 0.561 . . . . 0.0 110.902 -179.412 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 96.6 t -61.56 -44.29 98.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.183 179.633 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -54.71 -42.53 71.61 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 179.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.6 t -58.81 -44.77 90.89 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 179.736 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 12.0 m -63.3 -45.73 90.0 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.26 179.024 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 95.7 mt -64.85 -22.28 66.96 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.523 179.717 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -74.77 -55.66 5.6 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.425 179.49 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.66 -55.58 33.31 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.375 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.509 ' O ' ' O ' ' A' ' 31' ' ' ALA . 89.9 mt -44.94 -34.64 2.49 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.312 -179.565 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.509 ' O ' ' O ' ' A' ' 30' ' ' LEU . . . -56.41 -139.97 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 O-C-N 123.517 0.511 . . . . 0.0 110.568 179.152 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.456 ' O ' ' O ' ' A' ' 31' ' ' ALA . 85.4 m 57.23 115.3 0.02 OUTLIER Pre-proline 0 C--N 1.323 -0.575 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.547 179.784 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -49.55 -46.76 25.41 Favored 'Trans proline' 0 N--CA 1.493 1.465 0 C-N-CA 122.371 2.047 . . . . 0.0 112.722 -179.337 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 57.9 m -62.87 -46.82 86.05 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.307 -178.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.2 tpp180 -63.01 -47.62 82.3 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.448 -178.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 3.2 tt -60.38 -53.27 59.56 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.439 -178.636 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 62.1 ttp -50.77 -48.3 59.37 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-O 120.909 0.385 . . . . 0.0 110.167 179.776 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 5.5 mm -62.26 -43.83 98.44 Favored 'Isoleucine or valine' 0 C--O 1.239 0.519 0 CA-C-O 121.091 0.472 . . . . 0.0 110.525 179.501 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 14.3 mt -61.79 -41.11 97.32 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.288 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 9.8 m -58.36 -40.44 82.26 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.01 -0.541 . . . . 0.0 109.672 179.539 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.401 HE22 HD13 ' A' ' 56' ' ' ILE . 51.6 mt-30 -61.85 -44.28 97.15 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.469 179.499 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.517 ' O ' ' N ' ' A' ' 44' ' ' ASN . 80.5 mt -63.46 -31.57 72.76 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.127 179.472 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.526 HH21 ' CG ' ' A' ' 99' ' ' ASP . 33.4 tpt85 -33.9 -32.5 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 O-C-N 123.534 0.521 . . . . 0.0 110.866 -179.593 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.517 ' N ' ' O ' ' A' ' 42' ' ' LEU . 81.2 m-20 -72.44 -84.22 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.43 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 149.73 -76.37 0.24 Allowed Glycine 0 CA--C 1.527 0.82 0 N-CA-C 110.882 -0.887 . . . . 0.0 110.882 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -68.71 84.25 0.51 Allowed 'Trans proline' 0 C--N 1.307 -1.652 0 C-N-CA 122.742 2.294 . . . . 0.0 112.328 -179.379 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -156.9 68.07 4.33 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-O 121.045 0.45 . . . . 0.0 110.108 -179.747 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_exo -45.07 170.52 0.02 OUTLIER 'Trans proline' 0 C--N 1.298 -2.107 0 C-N-CA 122.416 2.078 . . . . 0.0 112.168 -179.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 80.8 t -54.32 -45.44 68.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.335 -179.593 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 15.1 m -61.34 -39.23 89.8 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.16 0.505 . . . . 0.0 110.292 179.117 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -66.31 -41.29 89.9 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.106 179.686 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.77 -42.58 99.17 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.775 -179.764 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.577 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -56.37 -47.78 78.19 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 179.323 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -54.64 -45.27 73.75 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.686 -0.406 . . . . 0.0 109.939 179.639 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -55.52 -57.59 11.27 Favored 'General case' 0 C--N 1.333 -0.139 0 C-N-CA 120.763 -0.375 . . . . 0.0 110.649 179.687 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.407 HG23 HD11 ' A' ' 56' ' ' ILE . 95.3 mt -80.48 -69.11 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.389 179.36 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . 0.577 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 131.95 75.93 0.12 Allowed Glycine 0 CA--C 1.521 0.438 0 N-CA-C 110.931 -0.868 . . . . 0.0 110.931 179.817 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.438 ' CB ' ' O ' ' A' ' 57' ' ' GLY . 1.1 tmm? 77.72 95.91 0.06 Allowed 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.708 179.581 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 19.9 tp10 -174.06 34.25 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.18 179.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -69.63 -20.91 63.59 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.957 -179.291 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 77.9 p -69.17 -43.55 74.03 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.958 -179.679 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.25 -35.79 81.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.266 179.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 87.0 t -66.97 -51.84 50.35 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.232 0 C-N-CA 120.727 -0.389 . . . . 0.0 110.433 -179.729 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 51.7 m -55.24 -44.04 75.14 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.53 -0.468 . . . . 0.0 110.358 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 76.1 m-70 -68.42 -44.1 75.73 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.033 179.733 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 64.9 mt-30 -60.77 -40.62 93.18 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.381 -179.693 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -68.06 -39.85 82.88 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 120.975 0.417 . . . . 0.0 110.561 179.141 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.514 ' NH1' HD22 ' A' ' 72' ' ' ASN . 17.5 tpt85 -58.81 -47.19 85.64 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.617 -178.916 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.444 ' CG2' ' H ' ' A' ' 70' ' ' LEU . 27.6 m -75.24 -53.05 17.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.525 179.902 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.444 ' H ' ' CG2' ' A' ' 69' ' ' VAL . 69.5 mt -52.94 -38.97 62.5 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 -179.612 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 78.4 ttt180 -68.45 -42.37 78.91 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.481 178.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 0.514 HD22 ' NH1' ' A' ' 68' ' ' ARG . 99.1 m-20 -60.08 -52.41 65.47 Favored 'General case' 0 C--N 1.333 -0.126 0 C-N-CA 120.646 -0.422 . . . . 0.0 110.426 -179.476 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.496 ' CD2' ' N ' ' A' ' 73' ' ' LEU . 3.9 mm? -67.28 -39.95 86.09 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.679 178.954 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 96.61 98.55 1.89 Allowed Glycine 0 CA--C 1.523 0.575 0 N-CA-C 110.938 -0.865 . . . . 0.0 110.938 -179.493 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.9 tp -163.05 -7.39 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.816 0.341 . . . . 0.0 110.76 179.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 33.6 m -140.61 163.37 22.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.271 -179.867 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 37.1 t -139.96 154.39 23.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.443 179.796 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -143.45 152.2 23.91 Favored Glycine 0 CA--C 1.522 0.486 0 N-CA-C 110.802 -0.919 . . . . 0.0 110.802 179.323 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . 0.452 ' OD1' ' N ' ' A' ' 79' ' ' ASP . 3.9 p-10 -133.08 107.18 8.07 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.667 0.27 . . . . 0.0 110.327 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 62.2 ttp180 -88.39 136.6 32.91 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.575 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.429 ' O ' ' OG ' ' A' ' 84' ' ' SER . . . -139.95 94.9 2.82 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.375 179.43 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 64.17 -115.7 8.21 Favored Glycine 0 CA--C 1.524 0.599 0 N-CA-C 110.395 -1.082 . . . . 0.0 110.395 -179.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 44.0 mmm-85 -94.83 -2.85 50.02 Favored 'General case' 0 C--N 1.33 -0.282 0 O-C-N 122.884 -0.186 . . . . 0.0 110.542 179.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' SER . . . . . 0.429 ' OG ' ' O ' ' A' ' 81' ' ' ALA . 12.6 p -104.11 178.21 4.62 Favored 'General case' 0 CA--C 1.513 -0.456 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 179.899 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.455 ' CD1' ' CD2' ' A' ' 87' ' ' TYR . 0.0 OUTLIER 176.91 153.51 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 123.706 0.629 . . . . 0.0 110.682 179.636 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 48.0 t -136.24 124.74 36.68 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.225 0 CA-C-O 120.858 0.361 . . . . 0.0 111.066 178.486 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.455 ' CD2' ' CD1' ' A' ' 85' ' ' ILE . 8.6 m-85 -108.27 126.08 52.41 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.076 178.904 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 38.6 m -148.65 166.72 27.49 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.365 -179.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 10.8 mt -61.65 152.42 30.85 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.272 -179.464 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 6.9 t80 -54.6 -49.43 70.48 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.43 -179.349 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 81.5 m-20 -130.99 -180.0 5.66 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 121.018 0.437 . . . . 0.0 110.373 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 19.1 m -95.37 -18.15 20.99 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.44 -179.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . 0.507 ' CG ' ' ND1' ' B' ' 223' ' ' HIS . 84.3 m-70 -43.46 -63.85 0.75 Allowed 'General case' 0 C--O 1.236 0.373 0 CA-C-O 120.978 0.418 . . . . 0.0 110.413 179.775 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 29.5 m -48.7 -35.02 6.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.189 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.41 -37.65 88.25 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.231 179.317 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.423 ' O ' ' OE2' ' A' ' 100' ' ' GLU . 99.1 mm-40 -63.17 -46.11 88.69 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 116.159 -0.473 . . . . 0.0 109.99 -179.894 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 9.0 mp -61.7 -43.52 98.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.133 -179.705 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 38.1 tp -65.47 -36.92 85.31 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.322 179.622 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . 0.526 ' CG ' HH21 ' A' ' 43' ' ' ARG . 94.7 m-20 -60.1 -45.5 92.75 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.113 -0.494 . . . . 0.0 109.895 -179.527 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.528 ' N ' ' OE1' ' A' ' 100' ' ' GLU . 0.4 OUTLIER -65.41 -53.24 45.95 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.284 -0.416 . . . . 0.0 109.997 179.586 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -53.24 -43.51 67.39 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.559 -0.456 . . . . 0.0 110.221 179.41 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 3.7 mm -60.59 -47.9 90.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 C-N-CA 120.369 -0.532 . . . . 0.0 110.516 -178.82 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -63.02 -40.12 96.81 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.391 -179.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . 0.443 ' ND1' ' CG ' ' B' ' 212' ' ' HIS . 81.3 t60 -60.21 -47.15 87.16 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.744 -179.65 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 11.0 t -74.34 -38.56 63.22 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.107 0.48 . . . . 0.0 111.222 179.76 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 81.9 tt0 -59.15 -39.09 81.32 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.793 -179.069 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 57.3 t-80 -53.74 -71.35 0.08 Allowed 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.215 -179.343 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.424 ' O ' ' O ' ' A' ' 109' ' ' HIS . 58.8 tp -96.48 97.22 9.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.946 0.403 . . . . 0.0 109.957 179.771 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . 0.424 ' O ' ' O ' ' A' ' 108' ' ' LEU . 86.9 m-70 -57.66 -155.13 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.472 179.847 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 86.8 mt -61.67 -42.42 98.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.784 -179.74 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 67.5 19.57 70.96 Favored Glycine 0 CA--C 1.519 0.303 0 N-CA-C 110.828 -0.909 . . . . 0.0 110.828 179.795 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 56.2 tp -101.48 84.74 2.64 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.839 0.352 . . . . 0.0 110.432 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 27.8 m -170.19 104.09 0.29 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.545 179.613 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 55.13 44.31 28.08 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.578 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 42.6 ttm180 -65.46 137.21 57.3 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.458 -179.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 70.5 m-70 -154.53 151.04 22.95 Favored Pre-proline 0 N--CA 1.452 -0.325 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.66 179.742 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_exo -44.98 -39.34 14.32 Favored 'Trans proline' 0 C--N 1.311 -1.414 0 C-N-CA 122.513 2.142 . . . . 0.0 112.246 179.518 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 62.2 m -60.72 -41.49 95.42 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.51 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . 53.56 45.48 28.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.6 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.729 0 CA-C-O 118.087 -1.396 . . . . 0.0 111.005 -179.956 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.314 0 N-CA-C 109.567 -1.413 . . . . 0.0 109.567 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 122' ' ' HIS . . . . . 0.431 ' O ' ' ND1' ' B' ' 122' ' ' HIS . 52.6 t-80 45.49 37.81 3.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.848 0.356 . . . . 0.0 110.599 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 123' ' ' GLY . . . . . . . . . . . . . . . -171.02 -179.09 41.98 Favored Glycine 0 CA--C 1.522 0.502 0 N-CA-C 110.776 -0.929 . . . . 0.0 110.776 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 35.9 m -119.67 131.44 72.19 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.293 0 CA-C-O 120.864 0.364 . . . . 0.0 110.532 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 125' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -61.69 -68.03 0.36 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.611 -179.804 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 147.66 145.95 4.26 Favored Glycine 0 CA--C 1.524 0.594 0 N-CA-C 110.826 -0.91 . . . . 0.0 110.826 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 127' ' ' ARG . . . . . . . . . . . . . 84.8 mtt85 -61.96 -43.07 99.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.707 0.289 . . . . 0.0 110.683 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 128' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 54.39 55.36 8.19 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.616 179.755 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 129' ' ' ARG . . . . . . . . . . . . . 83.6 mtm180 -66.5 147.71 98.87 Favored Pre-proline 0 N--CA 1.451 -0.377 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.673 -179.34 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -68.78 147.94 70.23 Favored 'Trans proline' 0 N--CA 1.494 1.519 0 C-N-CA 122.697 2.265 . . . . 0.0 111.941 179.658 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 45.3 t -107.54 98.66 8.24 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.312 179.28 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 132' ' ' ALA . . . . . . . . . . . . . . . -172.69 150.88 2.2 Favored Pre-proline 0 N--CA 1.449 -0.486 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.897 179.577 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 133' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -67.61 146.48 73.67 Favored 'Trans proline' 0 C--N 1.31 -1.47 0 C-N-CA 122.832 2.355 . . . . 0.0 111.675 179.439 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . 0.653 ' CD2' ' H ' ' B' ' 134' ' ' LEU . 1.2 pt? -108.94 2.63 21.52 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.736 179.873 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 135' ' ' ASP . . . . . 0.481 ' N ' ' OD1' ' B' ' 135' ' ' ASP . 26.5 p-10 -33.47 -47.08 0.21 Allowed 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 120.929 0.395 . . . . 0.0 110.841 -179.232 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 89.8 p -52.98 -50.59 63.84 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.293 179.098 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 137' ' ' GLN . . . . . 0.51 ' N ' ' O ' ' B' ' 134' ' ' LEU . 11.2 tp-100 -61.5 -44.22 97.47 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 109.851 -0.425 . . . . 0.0 109.851 179.786 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 138' ' ' ALA . . . . . . . . . . . . . . . -58.14 -29.24 65.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.23 179.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -72.57 -52.45 15.48 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 121.032 0.444 . . . . 0.0 110.395 179.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -64.75 -40.25 94.98 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.95 179.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 59.0 tt0 -64.6 -53.18 51.78 Favored 'General case' 0 C--O 1.241 0.642 0 CA-C-O 121.349 0.595 . . . . 0.0 110.859 -179.6 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 142' ' ' VAL . . . . . . . . . . . . . 96.8 t -62.76 -44.49 99.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.051 179.645 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -53.72 -43.97 69.46 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 179.717 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 14.8 t -57.99 -44.42 87.13 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 179.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 9.9 m -63.2 -45.64 90.74 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.102 178.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 96.2 mt -64.32 -22.56 66.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.524 179.583 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 147' ' ' GLN . . . . . . . . . . . . . 55.1 tt0 -75.02 -55.71 5.47 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.289 179.357 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -58.09 -55.58 33.16 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.371 -179.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.505 ' O ' ' O ' ' B' ' 150' ' ' ALA . 93.6 mt -45.41 -35.88 3.96 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.342 -179.557 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 150' ' ' ALA . . . . . 0.505 ' O ' ' O ' ' B' ' 149' ' ' LEU . . . -56.45 -139.76 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 O-C-N 123.56 0.537 . . . . 0.0 110.518 179.5 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 151' ' ' THR . . . . . 0.449 ' O ' ' O ' ' B' ' 150' ' ' ALA . 95.7 m 57.37 114.49 0.02 OUTLIER Pre-proline 0 C--N 1.323 -0.558 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.293 179.947 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -48.99 -47.76 20.52 Favored 'Trans proline' 0 N--CA 1.493 1.474 0 C-N-CA 122.292 1.995 . . . . 0.0 112.819 -179.042 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 67.9 m -61.91 -46.78 87.88 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.29 -179.022 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 3.2 tpp180 -62.61 -47.37 84.06 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.403 -178.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 155' ' ' LEU . . . . . . . . . . . . . 2.7 tt -60.74 -52.96 62.88 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.43 -178.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 63.0 ttp -50.42 -48.06 56.33 Favored 'General case' 0 C--O 1.238 0.488 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.243 179.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 5.9 mm -62.71 -44.0 99.11 Favored 'Isoleucine or valine' 0 C--O 1.238 0.497 0 CA-C-O 121.019 0.437 . . . . 0.0 110.623 179.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 63.3 mt -61.73 -41.7 97.99 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.532 179.541 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 9.9 m -58.0 -40.05 79.8 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.71 179.572 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 160' ' ' GLN . . . . . 0.402 HE22 HD13 ' B' ' 175' ' ' ILE . 49.9 mt-30 -63.05 -44.35 96.08 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.826 -0.35 . . . . 0.0 110.421 179.417 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 161' ' ' LEU . . . . . 0.466 ' O ' ' N ' ' B' ' 163' ' ' ASN . 76.7 mt -62.83 -31.76 72.83 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.142 179.502 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 162' ' ' ARG . . . . . 0.504 HH21 ' CG ' ' B' ' 218' ' ' ASP . 33.4 tpt85 -34.58 -33.69 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 O-C-N 123.548 0.53 . . . . 0.0 110.959 -179.612 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 163' ' ' ASN . . . . . 0.466 ' N ' ' O ' ' B' ' 161' ' ' LEU . 86.9 m-20 -70.13 -83.0 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.293 179.671 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . 147.92 -76.05 0.26 Allowed Glycine 0 CA--C 1.525 0.675 0 N-CA-C 110.933 -0.867 . . . . 0.0 110.933 179.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -68.36 84.41 0.47 Allowed 'Trans proline' 0 N--CA 1.496 1.62 0 C-N-CA 122.71 2.274 . . . . 0.0 112.298 -179.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -157.02 66.72 3.99 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.101 0.477 . . . . 0.0 110.169 -179.552 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -44.51 171.36 0.02 OUTLIER 'Trans proline' 0 C--N 1.299 -2.053 0 C-N-CA 122.452 2.101 . . . . 0.0 112.143 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . 83.0 t -54.26 -46.57 68.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.324 -179.409 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 169' ' ' THR . . . . . . . . . . . . . 12.6 m -61.6 -37.81 85.29 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.274 0.559 . . . . 0.0 110.417 179.272 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -67.01 -40.55 87.32 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.133 179.78 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.73 -42.07 99.49 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.9 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 172' ' ' ALA . . . . . 0.575 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -56.54 -48.47 77.22 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 179.406 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -54.56 -43.95 72.48 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.013 179.592 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -56.95 -55.85 29.29 Favored 'General case' 0 C--O 1.232 0.154 0 C-N-CA 120.696 -0.402 . . . . 0.0 110.687 179.698 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 175' ' ' ILE . . . . . 0.402 HD13 HE22 ' B' ' 160' ' ' GLN . 89.7 mt -81.97 -68.66 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.299 179.497 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 176' ' ' GLY . . . . . 0.575 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 132.33 72.71 0.1 OUTLIER Glycine 0 CA--C 1.52 0.37 0 N-CA-C 110.962 -0.855 . . . . 0.0 110.962 179.742 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 177' ' ' MET . . . . . 0.474 ' CB ' ' O ' ' B' ' 176' ' ' GLY . 1.2 tmm? 79.86 96.47 0.06 Allowed 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 120.914 -0.314 . . . . 0.0 110.794 179.517 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -174.5 34.18 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.202 179.799 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -68.54 -23.29 64.51 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.899 -179.484 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 69.8 p -66.45 -44.88 81.6 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.055 -179.75 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -62.59 -34.99 78.11 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.382 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 97.9 t -66.98 -52.34 45.01 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.225 0 C-N-CA 120.602 -0.439 . . . . 0.0 110.509 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 50.0 m -55.21 -43.89 74.85 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.57 -0.452 . . . . 0.0 110.455 -179.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 77.7 m-70 -67.78 -42.91 80.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.034 179.756 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 69.7 mt-30 -62.74 -39.97 95.77 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.338 -179.848 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -67.93 -40.59 83.3 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 120.993 0.425 . . . . 0.0 110.592 178.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 187' ' ' ARG . . . . . 0.606 ' NH1' HD22 ' B' ' 191' ' ' ASN . 16.8 tpt85 -58.65 -46.31 87.41 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.712 -178.737 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 188' ' ' VAL . . . . . 0.422 ' CG2' ' H ' ' B' ' 189' ' ' LEU . 29.4 m -75.85 -52.59 17.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.537 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 189' ' ' LEU . . . . . 0.422 ' H ' ' CG2' ' B' ' 188' ' ' VAL . 72.1 mt -53.53 -39.91 65.07 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.161 -0.472 . . . . 0.0 109.746 -179.793 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 77.3 ttt180 -67.16 -43.18 82.93 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.453 179.038 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 191' ' ' ASN . . . . . 0.606 HD22 ' NH1' ' B' ' 187' ' ' ARG . 93.8 m-20 -59.35 -51.66 68.95 Favored 'General case' 0 C--O 1.23 0.071 0 C-N-CA 120.553 -0.459 . . . . 0.0 110.395 -179.407 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 192' ' ' LEU . . . . . 0.473 ' CD2' ' N ' ' B' ' 192' ' ' LEU . 4.1 mm? -68.12 -39.34 82.79 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.83 178.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 96.05 97.89 1.81 Allowed Glycine 0 CA--C 1.522 0.522 0 N-CA-C 110.915 -0.874 . . . . 0.0 110.915 -179.58 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 4.2 tp -162.19 -9.0 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.904 0.383 . . . . 0.0 110.716 179.791 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 34.4 m -139.42 161.65 27.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.382 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 196' ' ' VAL . . . . . 0.402 ' CG1' ' N ' ' B' ' 197' ' ' GLY . 41.1 t -139.8 154.52 24.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 121.043 0.449 . . . . 0.0 110.473 179.892 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 197' ' ' GLY . . . . . 0.402 ' N ' ' CG1' ' B' ' 196' ' ' VAL . . . -143.21 153.09 24.56 Favored Glycine 0 CA--C 1.519 0.334 0 N-CA-C 111.002 -0.839 . . . . 0.0 111.002 179.505 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 198' ' ' ASP . . . . . 0.434 ' N ' ' OD1' ' B' ' 198' ' ' ASP . 5.8 p-10 -132.65 106.66 7.93 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.83 0.348 . . . . 0.0 110.456 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 61.6 ttp180 -84.87 132.12 34.43 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.642 179.787 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 200' ' ' ALA . . . . . . . . . . . . . . . -137.38 94.49 2.94 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.213 179.413 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 201' ' ' GLY . . . . . . . . . . . . . . . 64.66 -110.95 3.79 Favored Glycine 0 CA--C 1.521 0.463 0 N-CA-C 110.879 -0.889 . . . . 0.0 110.879 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 202' ' ' ARG . . . . . . . . . . . . . 41.0 mmm-85 -107.91 15.28 24.58 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 120.683 0.278 . . . . 0.0 110.526 -179.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 49.1 p -136.51 114.03 10.95 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-O 121.018 0.437 . . . . 0.0 110.53 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 204' ' ' ILE . . . . . 0.476 ' CD1' ' CD2' ' B' ' 206' ' ' TYR . 0.0 OUTLIER -116.07 154.94 17.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.308 179.635 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 58.8 t -129.18 123.55 58.61 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.187 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.686 178.738 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 206' ' ' TYR . . . . . 0.476 ' CD2' ' CD1' ' B' ' 204' ' ' ILE . 5.0 m-85 -107.24 129.81 54.82 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.655 179.207 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 49.2 m -150.59 168.56 23.9 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.361 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . 18.1 mt -63.21 152.12 38.45 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.376 -179.65 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -55.04 -48.71 73.07 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.368 -179.343 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 84.3 m-20 -132.88 177.84 7.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.936 0.398 . . . . 0.0 110.402 -179.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 24.3 m -92.83 -20.02 21.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.457 -179.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 212' ' ' HIS . . . . . 0.443 ' CG ' ' ND1' ' A' ' 104' ' ' HIS . 83.7 m-70 -41.24 -65.44 0.43 Allowed 'General case' 0 C--O 1.237 0.429 0 CA-C-O 120.912 0.387 . . . . 0.0 110.557 179.876 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 22.8 m -47.88 -34.06 4.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.199 179.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 214' ' ' ALA . . . . . . . . . . . . . . . -65.04 -38.34 90.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.255 179.205 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 215' ' ' GLN . . . . . 0.412 ' O ' ' OE2' ' B' ' 219' ' ' GLU . 99.4 mm-40 -62.09 -46.99 86.64 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 121.056 0.455 . . . . 0.0 110.095 -179.908 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 216' ' ' LEU . . . . . . . . . . . . . 8.0 mp -61.01 -42.64 98.84 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.27 -180.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 45.7 tp -65.86 -37.34 85.93 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.383 179.523 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 218' ' ' ASP . . . . . 0.504 ' CG ' HH21 ' B' ' 162' ' ' ARG . 99.5 m-20 -59.9 -43.8 94.63 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.17 -0.468 . . . . 0.0 109.957 -179.469 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 219' ' ' GLU . . . . . 0.497 ' OE1' ' N ' ' B' ' 219' ' ' GLU . 0.6 OUTLIER -67.94 -52.12 39.74 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.15 179.344 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -53.22 -44.22 67.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.166 179.477 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 4.9 mm -61.61 -45.9 97.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 C-N-CA 120.312 -0.555 . . . . 0.0 110.876 -179.34 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -63.36 -39.82 95.57 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.499 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 223' ' ' HIS . . . . . 0.507 ' ND1' ' CG ' ' A' ' 93' ' ' HIS . 81.5 t60 -60.85 -46.77 89.28 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.728 -179.832 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 10.5 t -73.91 -39.81 63.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.156 179.65 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -56.94 -40.19 75.92 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.653 -179.252 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 53.2 t-80 -53.51 -71.37 0.07 Allowed 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 120.568 -0.453 . . . . 0.0 110.338 -179.181 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 227' ' ' LEU . . . . . 0.418 ' O ' ' O ' ' B' ' 228' ' ' HIS . 46.9 tp -96.96 98.17 9.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.977 0.418 . . . . 0.0 110.077 179.934 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 228' ' ' HIS . . . . . 0.418 ' O ' ' O ' ' B' ' 227' ' ' LEU . 89.4 m-70 -57.68 -155.23 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.482 179.725 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 229' ' ' LEU . . . . . . . . . . . . . 85.0 mt -62.21 -42.17 99.05 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.503 -179.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . 67.63 20.49 72.06 Favored Glycine 0 CA--C 1.518 0.252 0 N-CA-C 110.928 -0.869 . . . . 0.0 110.928 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 231' ' ' LEU . . . . . 0.426 ' O ' ' OG ' ' B' ' 232' ' ' SER . 56.7 tp -102.18 84.43 2.49 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.742 0.306 . . . . 0.0 110.46 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 232' ' ' SER . . . . . 0.426 ' OG ' ' O ' ' B' ' 231' ' ' LEU . 47.5 m -170.46 105.61 0.29 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.614 179.586 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 233' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 54.17 42.9 31.32 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.547 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 234' ' ' ARG . . . . . . . . . . . . . 43.3 ttm180 -64.39 137.11 57.72 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.347 -179.717 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 235' ' ' HIS . . . . . . . . . . . . . 74.6 m-70 -154.22 150.67 22.78 Favored Pre-proline 0 CA--C 1.533 0.299 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.693 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 236' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_exo -44.28 -40.26 12.71 Favored 'Trans proline' 0 C--N 1.31 -1.465 0 C-N-CA 122.557 2.171 . . . . 0.0 112.246 179.281 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 237' ' ' SER . . . . . . . . . . . . . 69.8 m -60.16 -40.84 91.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.505 -179.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 238' ' ' ALA . . . . . . . . . . . . . . . 54.84 44.21 28.77 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.578 -179.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.702 0 CA-C-O 117.954 -1.47 . . . . 0.0 110.952 179.902 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.366 0 N-CA-C 109.517 -1.433 . . . . 0.0 109.517 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 77.8 m80 -153.47 67.69 0.78 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.792 0.329 . . . . 0.0 110.585 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 78.71 -169.74 54.41 Favored Glycine 0 CA--C 1.523 0.59 0 N-CA-C 111.04 -0.824 . . . . 0.0 111.04 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 97.6 t -63.25 -44.4 99.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 120.88 0.372 . . . . 0.0 110.71 -179.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 78.8 tt0 -132.21 147.72 52.43 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.511 -179.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -175.53 -161.68 25.39 Favored Glycine 0 CA--C 1.522 0.519 0 N-CA-C 110.728 -0.949 . . . . 0.0 110.728 -179.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 17.6 ptm180 -139.53 159.98 40.9 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.893 0.377 . . . . 0.0 110.52 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 36.9 p30 -151.6 167.66 27.41 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.395 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 7.8 mmp_? -142.56 75.38 18.91 Favored Pre-proline 0 N--CA 1.464 0.241 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.338 -179.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -58.42 143.63 97.52 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 C-N-CA 122.549 2.166 . . . . 0.0 112.123 179.695 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 63.1 m 52.98 87.66 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.516 179.76 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -175.02 74.27 0.3 Allowed Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.522 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -53.84 134.07 57.38 Favored 'Trans proline' 0 C--N 1.307 -1.658 0 C-N-CA 122.662 2.242 . . . . 0.0 111.831 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 67.8 mt -103.15 -133.32 0.3 Allowed 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.699 179.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 -97.81 -57.71 2.17 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.294 0.568 . . . . 0.0 110.994 179.54 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 93.4 p -58.77 -33.67 70.57 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.279 -179.424 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 54.3 mt-30 -68.59 -48.22 64.73 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.439 179.52 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -55.68 -38.42 69.6 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 -179.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.64 -53.13 45.68 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 120.996 0.427 . . . . 0.0 110.259 179.606 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.98 -43.37 95.16 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 120.702 -0.399 . . . . 0.0 110.842 -179.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -64.17 -53.13 54.28 Favored 'General case' 0 C--O 1.242 0.665 0 CA-C-O 121.394 0.616 . . . . 0.0 111.045 -179.463 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.478 ' O ' ' OG1' ' A' ' 26' ' ' THR . 96.0 t -61.73 -45.48 98.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.183 179.801 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.13 -41.3 83.39 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 179.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 45.6 t -57.08 -45.33 83.42 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 -179.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.478 ' OG1' ' O ' ' A' ' 23' ' ' VAL . 20.8 p -65.56 -44.68 86.02 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 120.755 -0.378 . . . . 0.0 110.497 178.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 96.1 mt -64.42 -23.72 67.38 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.661 179.482 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 57.0 tt0 -75.14 -57.38 3.93 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.54 179.543 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.26 -54.55 45.77 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 120.61 -0.436 . . . . 0.0 110.466 -179.417 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.489 ' O ' ' O ' ' A' ' 31' ' ' ALA . 88.7 mt -46.08 -34.62 4.27 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.27 -179.55 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.489 ' O ' ' O ' ' A' ' 30' ' ' LEU . . . -57.03 -129.44 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 O-C-N 123.642 0.589 . . . . 0.0 110.364 179.437 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.46 ' O ' ' O ' ' A' ' 31' ' ' ALA . 0.3 OUTLIER 52.8 108.31 0.02 OUTLIER Pre-proline 0 CA--C 1.54 0.572 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.331 179.561 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_exo -45.8 -59.91 1.03 Allowed 'Trans proline' 0 C--N 1.309 -1.523 0 C-N-CA 122.166 1.91 . . . . 0.0 112.882 -179.217 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 50.8 m -54.86 -45.7 74.61 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.869 -178.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 46.0 mmm-85 -61.79 -44.76 96.23 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.027 -179.582 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 2.0 tt -63.11 -49.0 76.16 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.423 -179.342 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 28.6 ttt -52.1 -48.53 64.72 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.242 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.408 HG23 HD11 ' A' ' 38' ' ' ILE . 38.2 mm -63.63 -43.4 98.14 Favored 'Isoleucine or valine' 0 C--O 1.244 0.801 0 CA-C-O 121.189 0.519 . . . . 0.0 110.574 179.542 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 15.7 tp -61.76 -41.28 97.48 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.225 -179.55 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 19.6 m -61.27 -42.41 98.58 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 179.364 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 10.6 tp-100 -54.34 -48.06 71.84 Favored 'General case' 0 C--O 1.233 0.19 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 17.2 mt -64.29 -40.15 95.38 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.509 -0.476 . . . . 0.0 111.087 178.774 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 30.1 ttm180 -46.03 -25.51 0.58 Allowed 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.35 -179.186 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -61.59 -39.84 92.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.582 -179.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 157.66 -176.89 34.67 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.911 -0.876 . . . . 0.0 110.911 179.846 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -78.35 117.9 4.17 Favored 'Trans proline' 0 C--N 1.309 -1.501 0 C-N-CA 122.885 2.39 . . . . 0.0 111.67 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -148.75 128.25 6.39 Favored Pre-proline 0 CA--C 1.543 0.693 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.368 -179.58 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -47.53 167.28 0.09 OUTLIER 'Trans proline' 0 C--N 1.307 -1.613 0 C-N-CA 122.266 1.978 . . . . 0.0 112.475 178.745 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.424 ' CG2' ' N ' ' A' ' 50' ' ' THR . 2.4 m -61.06 -37.36 77.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-O 121.586 0.708 . . . . 0.0 110.518 179.91 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.424 ' N ' ' CG2' ' A' ' 49' ' ' VAL . 26.9 m -59.99 -44.93 94.19 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 115.029 -0.987 . . . . 0.0 110.386 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 55.4 m-20 -66.21 -39.33 89.55 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.122 178.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.8 tt -61.55 -42.51 98.94 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.795 -179.886 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.563 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -60.75 -43.85 97.45 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 179.719 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -55.14 -44.79 75.4 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.63 -0.428 . . . . 0.0 109.878 179.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -62.53 -39.67 94.33 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.731 -0.388 . . . . 0.0 110.602 179.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 90.9 mt -94.38 -78.08 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.239 179.577 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . 0.563 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 150.11 83.55 0.04 OUTLIER Glycine 0 CA--C 1.521 0.408 0 N-CA-C 111.663 -0.575 . . . . 0.0 111.663 179.622 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.407 ' O ' ' OE1' ' A' ' 59' ' ' GLU . 87.1 mtp 57.49 103.32 0.02 OUTLIER 'General case' 0 CA--C 1.518 -0.283 0 CA-C-O 121.015 0.436 . . . . 0.0 111.047 179.008 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.407 ' OE1' ' O ' ' A' ' 58' ' ' MET . 3.6 tp10 -174.86 32.74 0.01 OUTLIER 'General case' 0 N--CA 1.456 -0.132 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.298 179.78 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 -63.1 -23.85 67.63 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.057 -178.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.443 ' HG ' ' H ' ' A' ' 62' ' ' ALA . 78.0 p -71.06 -43.73 67.19 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.087 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.443 ' H ' ' HG ' ' A' ' 61' ' ' SER . . . -64.07 -29.7 70.82 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.174 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 92.4 t -74.45 -52.07 20.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 C-N-CA 120.809 -0.356 . . . . 0.0 110.615 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 67.9 p -56.03 -45.43 79.16 Favored 'General case' 0 C--O 1.233 0.192 0 C-N-CA 120.533 -0.467 . . . . 0.0 110.651 -179.77 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 73.6 m-70 -66.25 -50.9 62.17 Favored 'General case' 0 C--O 1.242 0.662 0 CA-C-O 121.171 0.51 . . . . 0.0 111.235 -179.866 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 79.9 mt-30 -58.34 -31.56 67.69 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.245 179.458 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.416 ' O ' ' CG ' ' A' ' 71' ' ' ARG . 5.1 tp -69.65 -43.39 72.71 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.446 179.931 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 82.3 mtp180 -60.19 -49.75 76.4 Favored 'General case' 0 C--O 1.245 0.843 0 CA-C-O 121.512 0.673 . . . . 0.0 111.167 -179.298 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.447 ' CG1' ' H ' ' A' ' 70' ' ' LEU . 4.4 p -66.2 -54.55 25.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.349 179.523 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.447 ' H ' ' CG1' ' A' ' 69' ' ' VAL . 70.8 mt -54.17 -35.23 62.07 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 -179.65 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.416 ' CG ' ' O ' ' A' ' 67' ' ' LEU . 11.9 mmm180 -61.78 -40.46 95.29 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.651 179.148 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -62.78 -42.97 99.93 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.075 -179.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 6.9 mt -67.61 -42.34 82.57 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.422 -179.496 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 100.9 37.54 3.63 Favored Glycine 0 CA--C 1.522 0.483 0 N-CA-C 111.22 -0.752 . . . . 0.0 111.22 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -100.43 -15.37 17.95 Favored 'General case' 0 CA--C 1.512 -0.483 0 O-C-N 122.825 -0.221 . . . . 0.0 110.897 179.534 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 23.2 m -136.57 158.58 37.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-O 120.846 0.355 . . . . 0.0 110.049 -179.815 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.432 ' CG1' ' N ' ' A' ' 78' ' ' GLY . 40.1 t -142.48 156.53 18.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.622 179.836 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . 0.432 ' N ' ' CG1' ' A' ' 77' ' ' VAL . . . -105.13 167.68 15.18 Favored Glycine 0 CA--C 1.522 0.524 0 N-CA-C 110.309 -1.116 . . . . 0.0 110.309 179.555 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 68.0 t0 -146.05 122.38 10.93 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.602 0.239 . . . . 0.0 110.568 -179.374 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 77.1 mtp85 -77.12 163.49 26.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.887 179.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.463 ' O ' ' N ' ' A' ' 83' ' ' ARG . . . -166.98 107.95 0.64 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.753 -179.905 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 53.56 -87.88 0.01 OUTLIER Glycine 0 CA--C 1.522 0.508 0 N-CA-C 110.707 -0.957 . . . . 0.0 110.707 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.463 ' N ' ' O ' ' A' ' 81' ' ' ALA . 50.7 ttt85 -136.61 42.75 2.48 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 121.064 0.459 . . . . 0.0 110.089 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 87.7 p -163.65 162.17 24.06 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.793 0.33 . . . . 0.0 110.26 179.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 1.2 pp -134.25 155.59 39.47 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-O 120.88 0.372 . . . . 0.0 110.345 179.578 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 18.6 t -133.23 156.74 42.3 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.262 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.403 178.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 44.2 m-85 -106.0 136.64 45.3 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.532 -179.496 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 94.8 p -151.91 172.7 15.82 Favored 'General case' 0 C--O 1.224 -0.289 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.423 -179.798 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 56.3 mt -65.41 148.2 52.12 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.656 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 10.2 t80 -52.71 -48.5 66.59 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.312 -179.456 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.486 ' OD2' ' CD2' ' B' ' 227' ' ' LEU . 46.5 p-10 -146.77 -179.78 7.03 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.781 0.324 . . . . 0.0 110.555 -179.857 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 42.0 p -88.7 -16.34 32.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.558 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 58.4 m80 -46.88 -65.38 0.57 Allowed 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.048 0.452 . . . . 0.0 110.697 -179.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 11.9 p -52.79 -35.25 21.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.193 -179.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.97 -40.35 97.44 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.411 179.493 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -63.55 -44.45 94.12 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 116.013 -0.54 . . . . 0.0 109.895 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 13.9 tp -60.02 -42.71 94.94 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.158 -179.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 87.5 mt -63.39 -39.2 93.87 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.154 179.801 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -60.28 -42.86 96.33 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.103 -179.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 73.8 mm-40 -67.72 -47.69 68.64 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.542 179.617 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.14 -44.29 92.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.262 -0.426 . . . . 0.0 109.949 179.684 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 5.0 mm -62.94 -44.13 99.43 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.639 -179.561 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -60.08 -42.19 94.07 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.998 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 35.0 m170 -68.77 -35.96 77.72 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.245 179.788 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 7.0 t -59.02 -47.98 83.25 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.322 -179.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -74.8 -57.28 4.01 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.003 0.43 . . . . 0.0 110.431 179.465 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 53.3 m170 -52.32 -37.65 56.43 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.043 -179.867 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.501 ' CD2' ' OD2' ' B' ' 210' ' ' ASP . 39.1 tp -135.53 104.44 5.82 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.398 179.36 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . 0.446 ' O ' ' CG ' ' A' ' 109' ' ' HIS . 49.0 p-80 -116.19 105.46 12.6 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.866 179.636 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.467 ' CD1' ' N ' ' A' ' 110' ' ' LEU . 9.8 mp -64.13 -42.05 96.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.306 179.768 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 82.95 58.41 2.35 Favored Glycine 0 CA--C 1.521 0.444 0 N-CA-C 110.935 -0.866 . . . . 0.0 110.935 -179.743 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 55.8 tp -96.94 135.02 39.52 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.902 0.382 . . . . 0.0 110.531 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 47.3 t -63.54 145.25 56.04 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.648 179.651 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -81.29 -3.62 53.07 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.604 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 53.7 ptt85 -139.36 156.02 47.28 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.575 -179.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . 0.506 ' N ' ' HD2' ' A' ' 117' ' ' PRO . 0.4 OUTLIER 178.7 -58.91 0.0 OUTLIER Pre-proline 0 C--N 1.321 -0.644 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.943 -179.354 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . 0.506 ' HD2' ' N ' ' A' ' 116' ' ' HIS . 24.3 Cg_endo -60.64 -25.5 81.0 Favored 'Trans proline' 0 N--CA 1.491 1.339 0 C-N-CA 122.57 2.18 . . . . 0.0 111.738 -179.184 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 34.4 t -64.99 140.73 58.9 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.598 -179.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -162.4 -36.38 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.618 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.219 -0.789 0 CA-C-O 118.035 -1.425 . . . . 0.0 110.945 -179.958 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.354 0 N-CA-C 109.494 -1.442 . . . . 0.0 109.494 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 79.0 m80 -149.37 67.92 1.03 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.811 0.338 . . . . 0.0 110.522 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 123' ' ' GLY . . . . . . . . . . . . . . . 79.21 -169.42 53.88 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 111.006 -0.837 . . . . 0.0 111.006 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 90.5 t -63.32 -44.41 99.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 120.872 0.367 . . . . 0.0 110.768 179.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 125' ' ' GLU . . . . . . . . . . . . . 85.0 tt0 -133.15 147.21 52.08 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.556 -179.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -174.91 -161.05 23.98 Favored Glycine 0 CA--C 1.522 0.528 0 N-CA-C 110.792 -0.923 . . . . 0.0 110.792 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 127' ' ' ARG . . . . . . . . . . . . . 17.6 ptm180 -139.21 159.74 41.43 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.826 0.346 . . . . 0.0 110.482 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 128' ' ' ASN . . . . . . . . . . . . . 40.3 p30 -150.14 167.84 25.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.54 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 129' ' ' ARG . . . . . . . . . . . . . 7.8 mmp_? -144.05 74.74 15.99 Favored Pre-proline 0 C--N 1.331 -0.213 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.386 -179.801 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo -58.6 144.72 97.17 Favored 'Trans proline' 0 C--N 1.305 -1.743 0 C-N-CA 122.517 2.145 . . . . 0.0 112.146 179.617 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 50.3 m 55.86 83.78 0.09 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.465 179.83 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 132' ' ' ALA . . . . . . . . . . . . . . . -172.5 74.27 0.44 Allowed Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.246 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 133' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_exo -54.47 135.37 65.83 Favored 'Trans proline' 0 C--N 1.307 -1.642 0 C-N-CA 122.686 2.257 . . . . 0.0 111.977 -179.59 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . 0.53 ' O ' ' N ' ' B' ' 137' ' ' GLN . 58.7 mt -113.95 154.45 27.56 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.017 179.546 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 135' ' ' ASP . . . . . 0.438 ' C ' ' O ' ' B' ' 134' ' ' LEU . 98.0 m-20 -32.55 -48.78 0.2 Allowed 'General case' 0 N--CA 1.466 0.37 0 O-C-N 123.544 0.528 . . . . 0.0 110.591 -179.091 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 11.2 t -59.14 -48.79 80.32 Favored 'General case' 0 C--O 1.24 0.585 0 CA-C-O 121.189 0.519 . . . . 0.0 110.711 178.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 137' ' ' GLN . . . . . 0.53 ' N ' ' O ' ' B' ' 134' ' ' LEU . 73.8 mt-30 -64.53 -42.78 95.55 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.948 -179.881 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 138' ' ' ALA . . . . . . . . . . . . . . . -55.83 -38.86 70.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.08 -179.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -65.36 -53.25 46.25 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 120.933 0.396 . . . . 0.0 110.242 179.552 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -60.52 -41.85 95.22 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.532 -0.467 . . . . 0.0 110.879 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 59.5 tt0 -64.35 -53.71 44.43 Favored 'General case' 0 C--O 1.244 0.773 0 CA-C-O 121.415 0.626 . . . . 0.0 111.025 -179.573 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 142' ' ' VAL . . . . . 0.488 ' O ' ' OG1' ' B' ' 145' ' ' THR . 89.4 t -62.17 -45.68 98.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.006 179.684 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -57.27 -42.09 80.97 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 44.2 t -56.58 -45.84 81.11 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 -179.725 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 145' ' ' THR . . . . . 0.488 ' OG1' ' O ' ' B' ' 142' ' ' VAL . 21.7 p -65.16 -44.02 89.89 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 120.65 -0.42 . . . . 0.0 110.54 179.078 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 95.9 mt -64.37 -24.05 67.5 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.598 179.455 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 147' ' ' GLN . . . . . . . . . . . . . 55.9 tt0 -75.38 -57.05 4.13 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.536 179.607 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -57.95 -54.67 44.32 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.599 -179.32 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.501 ' O ' ' O ' ' B' ' 150' ' ' ALA . 92.9 mt -46.29 -35.56 5.43 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.319 -179.66 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 150' ' ' ALA . . . . . 0.501 ' O ' ' O ' ' B' ' 149' ' ' LEU . . . -56.69 -131.43 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.262 0.553 . . . . 0.0 110.407 179.6 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 151' ' ' THR . . . . . 0.454 ' O ' ' O ' ' B' ' 150' ' ' ALA . 0.4 OUTLIER 54.61 108.61 0.02 OUTLIER Pre-proline 0 CA--C 1.539 0.539 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.322 179.503 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -45.58 -61.45 0.59 Allowed 'Trans proline' 0 C--N 1.31 -1.494 0 C-N-CA 122.304 2.003 . . . . 0.0 112.868 -179.11 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 49.6 m -53.96 -46.7 71.69 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.0 -178.591 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 46.0 mmm-85 -60.46 -44.09 96.23 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 120.716 -0.394 . . . . 0.0 111.011 -179.502 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 155' ' ' LEU . . . . . . . . . . . . . 1.9 tt -64.18 -49.16 73.14 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.31 -179.389 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 28.6 ttt -51.61 -49.05 62.93 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.241 -179.459 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 42.8 mm -64.24 -43.69 97.3 Favored 'Isoleucine or valine' 0 C--O 1.247 0.931 0 CA-C-O 121.188 0.518 . . . . 0.0 110.437 179.737 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 17.6 tp -60.84 -42.1 97.11 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.262 -179.516 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 19.0 m -61.57 -41.59 97.62 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.858 179.383 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 10.4 tp-100 -53.45 -49.29 67.7 Favored 'General case' 0 C--O 1.233 0.202 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 161' ' ' LEU . . . . . 0.464 ' O ' ' N ' ' B' ' 163' ' ' ASN . 8.9 mt -64.29 -40.65 96.39 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.288 -0.565 . . . . 0.0 111.153 179.054 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 162' ' ' ARG . . . . . . . . . . . . . 32.6 ttm180 -42.14 -23.56 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.287 -179.213 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 163' ' ' ASN . . . . . 0.464 ' N ' ' O ' ' B' ' 161' ' ' LEU . 7.7 m120 -63.06 -41.46 99.46 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.624 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 164' ' ' GLY . . . . . 0.401 ' N ' ' O ' ' B' ' 161' ' ' LEU . . . 155.83 -170.36 33.65 Favored Glycine 0 CA--C 1.522 0.484 0 N-CA-C 111.09 -0.804 . . . . 0.0 111.09 179.523 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -74.24 120.27 6.2 Favored 'Trans proline' 0 N--CA 1.495 1.594 0 C-N-CA 122.916 2.411 . . . . 0.0 111.849 179.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -151.92 120.91 3.39 Favored Pre-proline 0 CA--C 1.545 0.768 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.633 179.843 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -47.6 168.67 0.07 OUTLIER 'Trans proline' 0 C--N 1.304 -1.788 0 C-N-CA 122.26 1.974 . . . . 0.0 112.317 178.633 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 168' ' ' VAL . . . . . 0.42 ' CG2' ' N ' ' B' ' 169' ' ' THR . 2.6 m -60.46 -37.75 75.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-O 121.698 0.761 . . . . 0.0 110.41 179.875 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 169' ' ' THR . . . . . 0.42 ' N ' ' CG2' ' B' ' 168' ' ' VAL . 14.0 m -60.7 -45.65 93.37 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 115.058 -0.973 . . . . 0.0 110.192 -179.944 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 71.5 m-20 -65.11 -41.15 95.17 Favored 'General case' 0 C--O 1.241 0.639 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.077 179.314 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 4.5 tt -61.32 -41.71 97.46 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.936 -179.541 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 172' ' ' ALA . . . . . 0.549 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -60.77 -44.03 97.28 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 179.649 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -55.26 -44.52 75.66 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.275 -0.42 . . . . 0.0 109.897 179.773 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -61.92 -41.04 97.47 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.47 179.623 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 96.7 mt -93.52 -79.04 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.183 179.486 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 176' ' ' GLY . . . . . 0.549 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 151.84 82.43 0.04 OUTLIER Glycine 0 CA--C 1.52 0.388 0 N-CA-C 111.518 -0.633 . . . . 0.0 111.518 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 177' ' ' MET . . . . . 0.435 ' O ' ' OE1' ' B' ' 178' ' ' GLU . 89.0 mtp 58.34 105.37 0.02 OUTLIER 'General case' 0 CA--C 1.518 -0.253 0 CA-C-O 120.853 0.359 . . . . 0.0 110.995 179.076 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 178' ' ' GLU . . . . . 0.435 ' OE1' ' O ' ' B' ' 177' ' ' MET . 4.0 tp10 -176.87 32.75 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.28 179.75 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 7.5 mt-30 -62.84 -23.8 67.46 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.031 -179.005 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 180' ' ' SER . . . . . 0.431 ' HG ' ' N ' ' B' ' 181' ' ' ALA . 78.7 p -70.95 -42.45 69.79 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.968 -179.697 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 181' ' ' ALA . . . . . 0.431 ' N ' ' HG ' ' B' ' 180' ' ' SER . . . -65.71 -28.91 69.4 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.299 -179.898 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 97.9 t -74.8 -52.47 19.14 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.126 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.547 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 79.4 p -56.32 -43.8 79.34 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 120.541 -0.464 . . . . 0.0 110.366 -179.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 64.5 m-70 -66.84 -50.93 60.99 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-O 121.163 0.506 . . . . 0.0 111.078 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -58.8 -31.48 68.46 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.214 179.507 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 186' ' ' LEU . . . . . 0.415 ' O ' ' CG ' ' B' ' 190' ' ' ARG . 5.1 tp -69.77 -43.46 72.15 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.549 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 81.3 mtp180 -60.02 -49.17 78.71 Favored 'General case' 0 C--O 1.246 0.876 0 CA-C-O 121.293 0.568 . . . . 0.0 111.144 -179.376 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 188' ' ' VAL . . . . . 0.447 ' CG1' ' H ' ' B' ' 189' ' ' LEU . 4.9 p -67.05 -54.39 24.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.243 179.726 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 189' ' ' LEU . . . . . 0.447 ' H ' ' CG1' ' B' ' 188' ' ' VAL . 73.4 mt -54.21 -35.63 62.6 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 -179.657 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 190' ' ' ARG . . . . . 0.415 ' CG ' ' O ' ' B' ' 186' ' ' LEU . 12.6 mmm180 -61.36 -40.56 94.76 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.63 179.12 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -62.92 -42.58 99.85 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 120.37 -0.532 . . . . 0.0 109.969 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 192' ' ' LEU . . . . . . . . . . . . . 7.2 mt -67.91 -38.29 82.78 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.42 -179.542 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 95.9 35.28 5.64 Favored Glycine 0 CA--C 1.521 0.427 0 N-CA-C 111.23 -0.748 . . . . 0.0 111.23 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -98.4 -15.89 19.5 Favored 'General case' 0 CA--C 1.512 -0.511 0 O-C-N 122.916 -0.167 . . . . 0.0 111.079 179.558 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 26.5 m -136.4 158.44 37.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.11 -179.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 196' ' ' VAL . . . . . 0.44 ' CG1' ' N ' ' B' ' 197' ' ' GLY . 41.2 t -142.77 156.76 18.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.595 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 197' ' ' GLY . . . . . 0.44 ' N ' ' CG1' ' B' ' 196' ' ' VAL . . . -106.08 168.69 15.13 Favored Glycine 0 CA--C 1.523 0.572 0 N-CA-C 110.418 -1.073 . . . . 0.0 110.418 179.6 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 67.9 t0 -146.38 122.76 10.98 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.769 0.319 . . . . 0.0 110.559 -179.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 77.7 mtp85 -76.86 163.07 27.11 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.842 179.618 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 200' ' ' ALA . . . . . 0.43 ' O ' ' N ' ' B' ' 202' ' ' ARG . . . -167.15 108.87 0.65 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.588 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 201' ' ' GLY . . . . . . . . . . . . . . . 53.75 -89.54 0.01 OUTLIER Glycine 0 CA--C 1.522 0.528 0 N-CA-C 110.709 -0.956 . . . . 0.0 110.709 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 202' ' ' ARG . . . . . 0.43 ' N ' ' O ' ' B' ' 200' ' ' ALA . 52.4 ttt85 -135.56 42.08 2.7 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 121.149 0.5 . . . . 0.0 110.07 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 84.5 p -162.78 162.97 26.88 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.872 0.368 . . . . 0.0 110.138 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 1.2 pp -133.83 156.71 41.53 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.423 179.701 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 21.4 t -132.93 158.43 43.27 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.391 178.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 206' ' ' TYR . . . . . 0.404 ' CE1' ' CD2' ' B' ' 186' ' ' LEU . 45.0 m-85 -108.77 135.5 49.89 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.332 -179.668 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 83.5 p -151.56 172.06 16.62 Favored 'General case' 0 C--O 1.224 -0.289 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.429 -179.759 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . 55.3 mt -65.63 149.12 50.61 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.529 -179.764 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 11.7 t80 -52.44 -48.72 65.61 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.326 -179.631 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 210' ' ' ASP . . . . . 0.501 ' OD2' ' CD2' ' A' ' 108' ' ' LEU . 42.5 p-10 -146.74 -178.94 6.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.77 0.319 . . . . 0.0 110.559 179.982 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 30.7 p -88.97 -17.04 30.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.374 -179.755 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 212' ' ' HIS . . . . . . . . . . . . . 46.3 m80 -45.12 -65.21 0.56 Allowed 'General case' 0 C--O 1.237 0.419 0 CA-C-O 121.045 0.45 . . . . 0.0 110.701 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 10.7 p -53.05 -35.64 23.05 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.178 -179.823 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 214' ' ' ALA . . . . . . . . . . . . . . . -62.09 -41.96 98.73 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.392 179.55 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -62.51 -45.12 94.43 Favored 'General case' 0 C--O 1.238 0.459 0 CA-C-N 116.172 -0.467 . . . . 0.0 109.894 -179.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 216' ' ' LEU . . . . . . . . . . . . . 18.4 tp -60.01 -42.38 94.16 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.06 -179.648 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 79.1 mt -63.72 -39.76 95.1 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.306 179.745 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 97.0 m-20 -59.66 -42.91 93.89 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.176 -179.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 219' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -67.16 -49.11 65.89 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.779 -0.368 . . . . 0.0 110.634 179.446 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -57.69 -44.99 86.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.285 -0.416 . . . . 0.0 109.924 179.689 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 4.8 mm -62.34 -43.98 98.7 Favored 'Isoleucine or valine' 0 C--O 1.237 0.442 0 CA-C-O 121.148 0.499 . . . . 0.0 110.612 -179.457 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -60.68 -42.22 96.66 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.937 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 223' ' ' HIS . . . . . . . . . . . . . 46.7 m170 -68.88 -36.3 77.91 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.113 179.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 43.0 t -58.73 -47.71 83.65 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.262 -179.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -74.9 -57.22 4.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.993 0.425 . . . . 0.0 110.586 179.236 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 59.2 m170 -52.53 -36.98 56.65 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.125 -179.809 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 227' ' ' LEU . . . . . 0.486 ' CD2' ' OD2' ' A' ' 91' ' ' ASP . 44.6 tp -136.36 104.25 5.55 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.499 179.371 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 228' ' ' HIS . . . . . 0.432 ' O ' ' CG ' ' B' ' 228' ' ' HIS . 48.0 p-80 -116.05 106.6 13.94 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 121.019 0.438 . . . . 0.0 110.766 179.46 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 229' ' ' LEU . . . . . 0.443 ' N ' ' CD1' ' B' ' 229' ' ' LEU . 10.4 mp -63.94 -41.23 97.67 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.415 179.747 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . 82.62 57.96 2.49 Favored Glycine 0 CA--C 1.521 0.415 0 N-CA-C 110.855 -0.898 . . . . 0.0 110.855 -179.624 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 231' ' ' LEU . . . . . . . . . . . . . 57.5 tp -97.37 137.77 35.84 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.785 0.326 . . . . 0.0 110.59 -179.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 232' ' ' SER . . . . . . . . . . . . . 41.1 t -66.82 146.08 54.8 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.559 179.46 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 233' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -81.65 -6.17 58.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.779 179.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 234' ' ' ARG . . . . . . . . . . . . . 53.5 ptt85 -136.36 156.9 47.97 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.966 0.413 . . . . 0.0 110.478 -179.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 235' ' ' HIS . . . . . 0.511 ' N ' ' HD2' ' B' ' 236' ' ' PRO . 0.4 OUTLIER 177.59 -58.63 0.0 OUTLIER Pre-proline 0 C--N 1.322 -0.621 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.862 -179.377 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 236' ' ' PRO . . . . . 0.511 ' HD2' ' N ' ' B' ' 235' ' ' HIS . 22.9 Cg_endo -60.45 -26.71 83.37 Favored 'Trans proline' 0 N--CA 1.492 1.439 0 C-N-CA 122.448 2.099 . . . . 0.0 111.664 -179.076 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 237' ' ' SER . . . . . . . . . . . . . 48.4 t -63.7 142.46 58.39 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.427 -179.52 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 238' ' ' ALA . . . . . . . . . . . . . . . -163.87 -33.22 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.598 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.778 0 CA-C-O 117.992 -1.449 . . . . 0.0 110.902 -179.928 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.258 0 N-CA-C 109.505 -1.438 . . . . 0.0 109.505 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 74.4 m80 -60.84 -41.42 95.8 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.84 0.352 . . . . 0.0 110.473 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . 0.426 ' O ' ' O ' ' A' ' 5' ' ' VAL . . . 74.49 -169.72 54.04 Favored Glycine 0 CA--C 1.524 0.652 0 N-CA-C 110.946 -0.862 . . . . 0.0 110.946 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.426 ' O ' ' O ' ' A' ' 4' ' ' GLY . 5.6 t 56.82 113.19 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 120.86 0.362 . . . . 0.0 110.527 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -122.34 124.85 44.66 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.536 179.881 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 51.32 80.28 0.07 OUTLIER Glycine 0 CA--C 1.523 0.587 0 N-CA-C 110.931 -0.868 . . . . 0.0 110.931 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 63.1 ttm-85 -61.17 -44.32 97.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.814 0.34 . . . . 0.0 110.548 -179.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.424 ' O ' ' OD1' ' A' ' 9' ' ' ASN . 45.0 p-10 -155.22 125.02 6.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.591 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.499 ' N ' ' CD ' ' A' ' 11' ' ' PRO . 24.6 ttm180 -168.35 50.6 0.19 Allowed Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.547 179.692 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.499 ' CD ' ' N ' ' A' ' 10' ' ' ARG . 36.5 Cg_endo -64.7 143.95 82.43 Favored 'Trans proline' 0 C--N 1.307 -1.637 0 C-N-CA 122.828 2.352 . . . . 0.0 111.924 179.849 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 20.8 p -83.1 139.61 33.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.358 179.602 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -178.74 149.4 0.62 Allowed Pre-proline 0 N--CA 1.449 -0.499 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.727 179.507 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -69.04 106.87 1.6 Allowed 'Trans proline' 0 N--CA 1.495 1.613 0 C-N-CA 122.476 2.117 . . . . 0.0 111.95 179.361 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 23.5 mt -92.36 122.16 34.55 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.151 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 95.0 m-20 -95.78 -53.02 3.85 Favored 'General case' 0 C--O 1.239 0.55 0 CA-C-O 121.258 0.552 . . . . 0.0 110.802 179.677 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 37.7 t -57.55 -42.75 83.57 Favored 'General case' 0 C--O 1.239 0.547 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.124 -179.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 9.1 mm100 -66.49 -42.66 87.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.28 179.521 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -51.74 -48.11 63.77 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 -179.209 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.34 -53.98 49.69 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 120.387 -0.525 . . . . 0.0 110.308 179.07 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -52.6 -48.24 66.41 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.03 179.803 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 85.8 mm-40 -56.32 -50.03 72.61 Favored 'General case' 0 C--O 1.241 0.614 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.688 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 84.2 t -60.12 -37.66 73.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.813 179.686 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.86 -42.07 95.16 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.411 178.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 67.1 m -56.9 -49.69 74.8 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.935 0.398 . . . . 0.0 110.99 -178.693 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.4 t -65.65 -48.68 71.32 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.725 179.832 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 69.1 mt -62.01 -26.06 68.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.946 179.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.667 ' NE2' ' NE2' ' B' ' 147' ' ' GLN . 29.6 tp60 -72.88 -60.12 2.38 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.352 179.224 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -55.64 -53.97 49.9 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.714 -179.189 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.511 ' O ' ' O ' ' A' ' 31' ' ' ALA . 7.3 mp -46.56 -35.45 5.83 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.397 -179.192 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.516 ' C ' ' HG1' ' A' ' 32' ' ' THR . . . -57.47 -132.69 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.45 0 O-C-N 123.52 0.512 . . . . 0.0 110.022 179.468 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.516 ' HG1' ' C ' ' A' ' 31' ' ' ALA . 0.8 OUTLIER 54.43 113.04 0.01 OUTLIER Pre-proline 0 CA--C 1.542 0.661 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.39 179.495 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -50.45 -57.58 2.2 Favored 'Trans proline' 0 N--CA 1.495 1.609 0 C-N-CA 122.283 1.989 . . . . 0.0 113.282 -179.541 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.503 ' HG ' ' N ' ' A' ' 35' ' ' ARG . 80.5 p -52.8 -46.09 67.52 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.22 -178.175 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.503 ' N ' ' HG ' ' A' ' 34' ' ' SER . 10.7 mpt_? -61.97 -42.67 99.4 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.637 -179.61 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.424 ' O ' ' OG1' ' A' ' 40' ' ' THR . 5.1 mt -61.37 -51.92 66.8 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 120.35 -0.54 . . . . 0.0 110.841 -179.159 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 11.2 tpt -53.83 -49.35 68.59 Favored 'General case' 0 C--O 1.24 0.574 0 C-N-CA 120.279 -0.568 . . . . 0.0 110.224 -179.62 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.431 HG23 HD12 ' A' ' 38' ' ' ILE . 96.7 mt -62.88 -45.58 98.5 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 CA-C-O 121.568 0.699 . . . . 0.0 110.405 -179.596 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 53.5 mt -62.21 -38.12 87.94 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.721 179.504 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.424 ' OG1' ' O ' ' A' ' 36' ' ' LEU . 18.0 m -59.41 -41.8 90.3 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.996 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.538 ' HG2' ' N ' ' A' ' 42' ' ' LEU . 0.0 OUTLIER -57.99 -43.82 86.8 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.282 -0.567 . . . . 0.0 110.269 179.839 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.538 ' N ' ' HG2' ' A' ' 41' ' ' GLN . 15.0 mt -64.19 -38.17 90.1 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.323 -179.411 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 73.6 ttp85 -51.0 -39.22 55.18 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.477 -179.402 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 51.4 t-20 -56.25 -39.55 72.77 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.411 -179.313 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 153.06 175.02 24.05 Favored Glycine 0 CA--C 1.524 0.595 0 N-CA-C 111.016 -0.834 . . . . 0.0 111.016 179.73 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -70.25 142.04 44.76 Favored 'Trans proline' 0 C--N 1.308 -1.6 0 C-N-CA 122.694 2.263 . . . . 0.0 111.764 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -162.81 160.62 19.44 Favored Pre-proline 0 C--N 1.326 -0.441 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.684 -179.838 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -63.26 142.01 84.47 Favored 'Trans proline' 0 N--CA 1.495 1.565 0 C-N-CA 122.519 2.146 . . . . 0.0 112.341 179.086 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 46.6 t -62.28 -43.16 97.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.423 179.457 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 89.6 m -55.86 -69.28 0.15 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.825 -179.317 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 63.1 t0 -52.23 -40.67 61.93 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.226 0.536 . . . . 0.0 109.719 -179.33 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.473 ' C ' ' CD1' ' A' ' 52' ' ' LEU . 2.9 tm? -59.02 -48.22 82.38 Favored 'General case' 0 C--N 1.316 -0.875 0 C-N-CA 119.732 -0.787 . . . . 0.0 110.336 -179.451 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.578 ' O ' ' N ' ' A' ' 58' ' ' MET . . . -56.34 -39.23 72.49 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.358 0.599 . . . . 0.0 110.315 -179.333 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -65.04 -28.8 69.73 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.592 179.476 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -63.28 -43.42 97.98 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.923 179.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 8.5 tt -164.14 -36.06 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.921 -179.556 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -54.74 -71.47 0.71 Allowed Glycine 0 CA--C 1.522 0.515 0 N-CA-C 111.205 -0.758 . . . . 0.0 111.205 -178.197 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.578 ' N ' ' O ' ' A' ' 53' ' ' ALA . 0.1 OUTLIER 64.64 27.21 13.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.678 0.275 . . . . 0.0 110.345 179.749 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -153.76 59.07 0.74 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.908 0.385 . . . . 0.0 110.034 -179.323 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 11.0 mt-30 -44.3 -26.05 0.29 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.525 -179.629 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 49.5 m -70.39 -46.12 64.65 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.896 179.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.76 -32.25 73.85 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.327 179.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 57.7 t -70.38 -50.63 44.64 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.273 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.689 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 11.2 t -58.08 -43.27 86.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.341 -179.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -62.12 -50.87 70.18 Favored 'General case' 0 C--O 1.239 0.501 0 CA-C-O 121.048 0.451 . . . . 0.0 110.79 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 86.6 mt-30 -63.36 -35.42 80.34 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.312 179.72 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 6.7 tp -62.99 -44.67 95.41 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.301 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -61.77 -40.7 96.11 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.796 0.331 . . . . 0.0 110.293 179.878 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 89.3 t -65.73 -54.28 29.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 C-N-CA 120.159 -0.616 . . . . 0.0 110.594 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 91.1 mt -60.9 -39.21 88.44 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.879 0.371 . . . . 0.0 110.059 -179.591 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 77.3 ttt-85 -59.63 -40.91 89.17 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.399 179.744 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 13.4 m120 -56.89 -47.53 80.27 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.338 -179.253 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.482 ' CD2' ' N ' ' A' ' 73' ' ' LEU . 4.0 mm? -65.89 -41.28 91.74 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.685 179.321 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 110.19 33.54 2.53 Favored Glycine 0 CA--C 1.526 0.749 0 N-CA-C 110.978 -0.849 . . . . 0.0 110.978 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.49 ' CD2' ' N ' ' A' ' 75' ' ' LEU . 3.8 mm? -91.2 -18.37 24.54 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.781 0.324 . . . . 0.0 110.601 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 31.6 m -136.38 160.13 38.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.159 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 46.5 t -134.54 142.07 41.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.421 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -115.57 140.7 16.42 Favored Glycine 0 CA--C 1.525 0.66 0 N-CA-C 110.496 -1.042 . . . . 0.0 110.496 179.299 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -118.32 105.21 11.5 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 120.837 0.351 . . . . 0.0 110.385 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 59.4 ttt85 -75.54 123.77 26.04 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.356 179.796 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -131.29 144.94 51.65 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.232 179.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -43.91 -35.83 3.49 Favored Glycine 0 CA--C 1.524 0.603 0 N-CA-C 110.778 -0.929 . . . . 0.0 110.778 -179.661 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.448 ' O ' ' OG ' ' A' ' 84' ' ' SER . 61.5 ttm-85 -70.71 -45.47 64.88 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.848 -0.341 . . . . 0.0 110.494 179.729 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' SER . . . . . 0.448 ' OG ' ' O ' ' A' ' 83' ' ' ARG . 3.5 m 177.81 176.35 0.43 Allowed 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 121.017 0.437 . . . . 0.0 110.03 -179.564 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 2.1 tp -97.63 131.16 45.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.036 -0.529 . . . . 0.0 109.698 178.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 54.5 t -111.73 134.34 54.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.222 179.126 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 65.4 m-85 -110.72 133.22 53.53 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.325 179.787 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.625 ' HG ' ' H ' ' A' ' 89' ' ' LEU . 26.0 t -151.14 172.13 16.27 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.143 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.625 ' H ' ' HG ' ' A' ' 88' ' ' SER . 60.3 mt -69.61 147.67 50.38 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.629 -179.728 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 6.9 t80 -54.54 -47.66 72.91 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.36 -179.668 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 45.6 t0 -147.03 165.29 30.34 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.869 0.366 . . . . 0.0 110.601 -179.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 80.8 p -75.1 -22.32 58.33 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.578 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 25.6 m170 -40.22 -66.13 0.34 Allowed 'General case' 0 C--O 1.236 0.368 0 CA-C-O 121.101 0.477 . . . . 0.0 110.637 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 22.7 m -50.48 -35.35 12.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.101 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.55 -41.06 96.56 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.542 179.607 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 96.5 mm-40 -61.27 -45.79 93.05 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.925 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 15.2 tp -60.09 -43.53 95.45 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.302 -0.559 . . . . 0.0 110.102 -179.632 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 52.3 tp -64.21 -38.06 89.7 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.077 -179.77 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.9 m-20 -60.99 -43.5 98.74 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.233 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -67.02 -43.83 81.81 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.352 179.334 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.07 -44.04 91.81 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.183 -0.462 . . . . 0.0 109.78 179.216 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 4.8 mm -63.85 -43.71 97.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 121.213 0.53 . . . . 0.0 110.588 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -60.73 -44.4 96.71 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.082 -179.886 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . 0.623 ' ND1' ' N ' ' A' ' 105' ' ' SER . 0.0 OUTLIER -67.72 -34.65 77.28 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.103 179.523 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.623 ' N ' ' ND1' ' A' ' 104' ' ' HIS . 5.6 t -59.15 -50.59 73.46 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.383 -178.141 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 13.2 tm-20 -75.35 -52.89 9.72 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.93 179.265 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 4.2 m-70 -48.71 -28.58 3.68 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.123 -178.733 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 66.9 mt -111.58 -67.3 1.01 Allowed 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.542 179.286 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . 0.523 ' N ' ' O ' ' A' ' 105' ' ' SER . 49.5 t-80 55.32 70.34 0.64 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.491 -179.801 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 96.1 mt -63.03 -41.62 99.58 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.392 -179.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . 0.441 ' O ' ' O ' ' A' ' 112' ' ' LEU . . . 80.42 -160.7 44.11 Favored Glycine 0 CA--C 1.524 0.621 0 N-CA-C 110.868 -0.893 . . . . 0.0 110.868 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.441 ' O ' ' O ' ' A' ' 111' ' ' GLY . 10.3 mp 56.42 157.84 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.998 0.428 . . . . 0.0 110.43 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 26.7 p -78.68 165.83 23.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.302 179.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . 0.532 ' C ' ' HD1' ' A' ' 116' ' ' HIS . 43.7 p-10 -133.75 148.73 51.43 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.45 179.815 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.518 ' O ' ' CG ' ' A' ' 116' ' ' HIS . 84.8 mtp180 53.26 -86.35 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.487 -179.706 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . 0.532 ' HD1' ' C ' ' A' ' 114' ' ' ASP . 44.7 p-80 40.43 71.21 1.29 Allowed Pre-proline 0 C--N 1.332 -0.157 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.583 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_exo -58.84 143.17 99.41 Favored 'Trans proline' 0 C--N 1.305 -1.735 0 C-N-CA 122.756 2.304 . . . . 0.0 112.052 -179.627 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 48.0 m -60.96 -43.32 98.93 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.478 179.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -67.8 142.89 56.05 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.623 179.844 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.219 -0.814 0 CA-C-O 118.072 -1.404 . . . . 0.0 110.92 -179.888 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.333 0 N-CA-C 109.549 -1.42 . . . . 0.0 109.549 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 75.0 m80 -65.67 -40.79 92.79 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.787 0.327 . . . . 0.0 110.451 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 123' ' ' GLY . . . . . 0.431 ' O ' ' O ' ' B' ' 124' ' ' VAL . . . 74.22 -169.89 53.68 Favored Glycine 0 CA--C 1.524 0.623 0 N-CA-C 111.011 -0.836 . . . . 0.0 111.011 179.897 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 124' ' ' VAL . . . . . 0.431 ' O ' ' O ' ' B' ' 123' ' ' GLY . 7.3 t 56.94 113.58 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.805 0.335 . . . . 0.0 110.475 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 125' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -121.17 125.78 48.02 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.463 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 49.22 82.07 0.04 OUTLIER Glycine 0 CA--C 1.524 0.638 0 N-CA-C 110.834 -0.907 . . . . 0.0 110.834 179.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 127' ' ' ARG . . . . . . . . . . . . . 61.1 ttm-85 -60.81 -43.73 97.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.747 0.308 . . . . 0.0 110.552 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 128' ' ' ASN . . . . . 0.419 ' O ' ' OD1' ' B' ' 128' ' ' ASN . 47.9 p-10 -155.33 128.08 8.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.386 179.956 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 129' ' ' ARG . . . . . 0.49 ' N ' ' CD ' ' B' ' 130' ' ' PRO . 27.4 ttm180 -171.13 51.44 0.16 Allowed Pre-proline 0 C--N 1.328 -0.366 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.475 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 130' ' ' PRO . . . . . 0.49 ' CD ' ' N ' ' B' ' 129' ' ' ARG . 37.5 Cg_endo -65.72 143.34 73.85 Favored 'Trans proline' 0 C--N 1.306 -1.694 0 C-N-CA 122.731 2.287 . . . . 0.0 111.929 179.929 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 17.9 p -82.59 139.92 33.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.324 179.53 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 132' ' ' ALA . . . . . . . . . . . . . . . 178.55 150.88 0.44 Allowed Pre-proline 0 N--CA 1.449 -0.49 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.632 179.546 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 133' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -67.85 116.88 4.52 Favored 'Trans proline' 0 N--CA 1.495 1.576 0 C-N-CA 122.678 2.252 . . . . 0.0 111.793 179.344 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 37.7 mt -102.62 121.28 42.08 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.124 179.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 91.0 m-20 -95.99 -53.21 3.75 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-O 121.281 0.563 . . . . 0.0 110.979 179.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 5.6 t -57.67 -44.65 85.9 Favored 'General case' 0 C--O 1.24 0.555 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.444 -179.326 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 9.5 mm100 -66.44 -42.17 88.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.35 179.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 138' ' ' ALA . . . . . . . . . . . . . . . -51.7 -47.51 63.9 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.457 -0.572 . . . . 0.0 109.457 -179.049 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -61.53 -53.45 56.17 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 120.329 -0.548 . . . . 0.0 110.196 178.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -52.66 -47.36 67.16 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 120.74 -0.384 . . . . 0.0 111.088 179.767 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 88.6 mm-40 -56.61 -49.46 74.89 Favored 'General case' 0 C--O 1.241 0.608 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.647 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 142' ' ' VAL . . . . . . . . . . . . . 80.3 t -60.94 -38.31 79.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.891 179.617 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -64.36 -42.02 96.43 Favored 'General case' 0 C--O 1.22 -0.481 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.485 178.819 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 75.3 m -56.3 -50.05 72.54 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.914 0.388 . . . . 0.0 110.956 -178.736 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 1.4 t -65.81 -48.96 69.94 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.925 179.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 68.9 mt -61.44 -26.4 67.85 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.858 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 147' ' ' GLN . . . . . 0.667 ' NE2' ' NE2' ' A' ' 28' ' ' GLN . 31.0 tp60 -73.25 -59.08 2.87 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.341 179.178 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -56.24 -54.0 50.47 Favored 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 120.761 -0.375 . . . . 0.0 110.728 -179.319 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.512 ' O ' ' O ' ' B' ' 150' ' ' ALA . 7.4 mp -46.47 -34.75 5.01 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.266 -179.105 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 150' ' ' ALA . . . . . 0.512 ' O ' ' O ' ' B' ' 149' ' ' LEU . . . -57.6 -130.81 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.548 0 O-C-N 123.641 0.588 . . . . 0.0 109.955 179.381 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 151' ' ' THR . . . . . 0.49 ' O ' ' O ' ' B' ' 150' ' ' ALA . 0.7 OUTLIER 52.85 111.81 0.01 OUTLIER Pre-proline 0 CA--C 1.542 0.66 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.393 179.72 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -49.69 -57.02 2.58 Favored 'Trans proline' 0 N--CA 1.496 1.624 0 C-N-CA 122.149 1.899 . . . . 0.0 113.425 -179.381 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 153' ' ' SER . . . . . 0.502 ' HG ' ' N ' ' B' ' 154' ' ' ARG . 61.1 p -53.36 -46.34 69.54 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.165 -178.135 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 154' ' ' ARG . . . . . 0.502 ' N ' ' HG ' ' B' ' 153' ' ' SER . 10.6 mpt_? -61.28 -42.41 98.6 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.51 -179.623 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 155' ' ' LEU . . . . . 0.434 ' O ' ' OG1' ' B' ' 159' ' ' THR . 4.9 mt -61.58 -51.8 67.05 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 120.375 -0.53 . . . . 0.0 110.749 -179.178 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 11.4 tpt -53.91 -48.83 69.76 Favored 'General case' 0 C--O 1.24 0.6 0 C-N-CA 120.263 -0.575 . . . . 0.0 110.351 -179.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 157' ' ' ILE . . . . . 0.431 ' O ' ' HG2' ' B' ' 160' ' ' GLN . 96.6 mt -63.38 -45.41 98.15 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 CA-C-O 121.67 0.748 . . . . 0.0 110.395 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 52.4 mt -62.33 -38.29 88.9 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.574 179.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 159' ' ' THR . . . . . 0.434 ' OG1' ' O ' ' B' ' 155' ' ' LEU . 11.7 m -59.42 -42.7 92.44 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.977 -179.972 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 160' ' ' GLN . . . . . 0.545 ' HG2' ' N ' ' B' ' 161' ' ' LEU . 0.0 OUTLIER -57.14 -44.33 83.29 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 120.384 -0.526 . . . . 0.0 110.316 179.875 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 161' ' ' LEU . . . . . 0.545 ' N ' ' HG2' ' B' ' 160' ' ' GLN . 13.9 mt -64.55 -37.25 86.89 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.254 -179.335 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 162' ' ' ARG . . . . . . . . . . . . . 73.5 ttp85 -52.19 -38.2 57.11 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.323 -179.363 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 49.8 t-20 -56.32 -40.76 74.9 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.86 0.362 . . . . 0.0 110.212 -179.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . 153.18 178.07 27.37 Favored Glycine 0 CA--C 1.524 0.612 0 N-CA-C 111.17 -0.772 . . . . 0.0 111.17 179.09 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_exo -69.08 143.83 55.52 Favored 'Trans proline' 0 C--N 1.312 -1.382 0 C-N-CA 122.764 2.309 . . . . 0.0 112.103 -179.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -165.69 159.48 13.42 Favored Pre-proline 0 C--N 1.326 -0.427 0 C-N-CA 120.336 -0.546 . . . . 0.0 110.714 179.682 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -63.81 142.53 83.04 Favored 'Trans proline' 0 N--CA 1.495 1.598 0 C-N-CA 122.413 2.075 . . . . 0.0 112.367 178.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . 48.0 t -62.69 -42.85 97.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.398 179.437 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 169' ' ' THR . . . . . . . . . . . . . 17.0 m -55.83 -69.18 0.15 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.817 -179.608 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 47.6 t0 -52.39 -40.42 62.05 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-O 121.362 0.601 . . . . 0.0 109.818 -179.18 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 171' ' ' LEU . . . . . 0.483 ' C ' ' CD1' ' B' ' 171' ' ' LEU . 2.9 tm? -59.59 -47.95 83.55 Favored 'General case' 0 N--CA 1.439 -0.975 0 C-N-CA 119.707 -0.797 . . . . 0.0 110.413 -179.589 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 172' ' ' ALA . . . . . 0.553 ' O ' ' N ' ' B' ' 177' ' ' MET . . . -56.36 -39.69 73.31 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.345 0.593 . . . . 0.0 110.252 -179.444 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -64.3 -28.45 69.72 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.575 179.312 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -63.64 -41.0 98.28 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.093 -179.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 6.0 tt -168.72 -33.5 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.895 -179.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . -54.78 -63.87 4.85 Favored Glycine 0 CA--C 1.523 0.552 0 C-N-CA 120.812 -0.709 . . . . 0.0 111.472 -178.156 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 177' ' ' MET . . . . . 0.553 ' N ' ' O ' ' B' ' 172' ' ' ALA . 3.4 mmt 56.07 29.22 14.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.716 0.293 . . . . 0.0 110.269 -179.917 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 86.4 mt-10 -155.35 60.87 0.63 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.36 -179.575 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 -47.1 -28.19 1.66 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.504 -179.583 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 48.0 m -69.92 -45.4 67.62 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.769 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -65.02 -32.21 73.83 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.437 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 63.5 t -70.22 -50.5 46.44 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.266 0 C-N-CA 120.873 -0.331 . . . . 0.0 110.755 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 13.5 t -58.7 -41.81 87.13 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.217 -179.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -62.6 -50.97 69.16 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-O 121.089 0.471 . . . . 0.0 110.779 -179.963 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -64.12 -34.12 77.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.145 179.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 7.2 tp -63.47 -45.15 92.12 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.172 179.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -61.81 -41.74 98.14 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.752 0.31 . . . . 0.0 110.262 -179.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 83.9 t -64.07 -54.67 28.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 C-N-CA 120.107 -0.637 . . . . 0.0 110.474 -179.834 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 93.0 mt -61.07 -39.07 88.5 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 -179.445 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 73.0 ttt-85 -58.72 -40.43 83.73 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.482 179.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 17.6 m120 -58.17 -46.43 85.74 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.674 -0.41 . . . . 0.0 110.442 -179.468 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 192' ' ' LEU . . . . . 0.489 ' CD2' ' N ' ' B' ' 192' ' ' LEU . 3.9 mm? -66.49 -41.01 89.59 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.631 179.4 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 108.74 34.57 2.59 Favored Glycine 0 CA--C 1.524 0.608 0 N-CA-C 111.015 -0.834 . . . . 0.0 111.015 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 194' ' ' LEU . . . . . 0.49 ' CD2' ' N ' ' B' ' 194' ' ' LEU . 3.9 mm? -92.31 -17.6 24.5 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.82 0.343 . . . . 0.0 110.519 179.942 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 27.5 m -137.29 160.49 35.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.232 179.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 196' ' ' VAL . . . . . . . . . . . . . 50.4 t -135.49 143.59 36.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.284 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 197' ' ' GLY . . . . . . . . . . . . . . . -117.09 141.15 16.45 Favored Glycine 0 CA--C 1.523 0.575 0 N-CA-C 110.643 -0.983 . . . . 0.0 110.643 179.605 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -118.11 105.49 11.88 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 120.864 0.364 . . . . 0.0 110.466 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 61.2 ttt85 -75.46 123.94 26.29 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.18 179.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 200' ' ' ALA . . . . . . . . . . . . . . . -130.94 145.41 52.02 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.396 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 201' ' ' GLY . . . . . . . . . . . . . . . -44.21 -38.23 4.85 Favored Glycine 0 CA--C 1.523 0.54 0 N-CA-C 110.666 -0.974 . . . . 0.0 110.666 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 202' ' ' ARG . . . . . 0.448 ' O ' ' OG ' ' B' ' 203' ' ' SER . 63.1 ttm-85 -68.29 -45.32 73.39 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.763 -0.375 . . . . 0.0 110.57 179.699 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 203' ' ' SER . . . . . 0.448 ' OG ' ' O ' ' B' ' 202' ' ' ARG . 3.6 m 177.44 176.73 0.37 Allowed 'General case' 0 N--CA 1.454 -0.249 0 CA-C-O 121.097 0.475 . . . . 0.0 109.902 -179.652 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 2.4 tp -96.98 133.65 37.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.689 178.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 58.5 t -114.75 135.31 55.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.189 179.38 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 -111.85 133.84 53.8 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.429 179.691 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 207' ' ' SER . . . . . 0.586 ' HG ' ' N ' ' B' ' 208' ' ' LEU . 45.5 t -151.78 172.33 16.31 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.211 179.902 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 208' ' ' LEU . . . . . 0.586 ' N ' ' HG ' ' B' ' 207' ' ' SER . 56.8 mt -69.11 147.72 51.02 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.56 -179.729 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 7.2 t80 -54.56 -46.29 73.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.257 -179.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 210' ' ' ASP . . . . . 0.509 ' OD2' ' CD2' ' B' ' 212' ' ' HIS . 45.2 t0 -147.91 170.58 17.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.557 -179.665 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 81.6 p -80.14 -19.36 47.41 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.63 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 212' ' ' HIS . . . . . 0.509 ' CD2' ' OD2' ' B' ' 210' ' ' ASP . 22.3 m170 -43.38 -65.84 0.45 Allowed 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.159 0.504 . . . . 0.0 110.738 -179.851 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 29.4 m -50.41 -36.8 13.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.214 -179.667 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 214' ' ' ALA . . . . . . . . . . . . . . . -63.16 -40.28 97.1 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.501 179.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 97.4 mm-40 -62.36 -45.89 91.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.987 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 216' ' ' LEU . . . . . . . . . . . . . 15.3 tp -59.62 -43.55 93.76 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.227 -0.589 . . . . 0.0 110.02 -179.551 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 56.1 tp -63.89 -39.58 94.5 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.046 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 99.9 m-20 -59.41 -44.04 92.9 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.352 -179.599 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 219' ' ' GLU . . . . . . . . . . . . . 67.7 mm-40 -66.26 -44.02 84.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.457 179.105 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -59.32 -44.17 92.61 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 179.284 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 4.7 mm -63.36 -44.01 98.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 121.158 0.504 . . . . 0.0 110.457 -179.886 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 222' ' ' TYR . . . . . 0.441 ' O ' ' CG ' ' B' ' 226' ' ' HIS . 3.8 m-85 -61.2 -42.83 99.29 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.111 -179.801 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 223' ' ' HIS . . . . . 0.629 ' ND1' ' N ' ' B' ' 224' ' ' SER . 0.0 OUTLIER -68.76 -36.37 78.25 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.061 0.458 . . . . 0.0 110.228 179.431 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 224' ' ' SER . . . . . 0.629 ' N ' ' ND1' ' B' ' 223' ' ' HIS . 41.6 t -58.84 -49.09 79.04 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.122 -178.097 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 9.6 tm-20 -75.58 -54.42 7.02 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.955 179.135 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 226' ' ' HIS . . . . . 0.441 ' CG ' ' O ' ' B' ' 222' ' ' TYR . 4.7 m-70 -48.1 -26.89 2.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.21 -178.695 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 227' ' ' LEU . . . . . . . . . . . . . 57.9 mt -112.84 -68.32 0.94 Allowed 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.48 179.302 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 228' ' ' HIS . . . . . 0.531 ' N ' ' O ' ' B' ' 224' ' ' SER . 52.1 t-80 56.38 69.89 0.7 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.542 179.97 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 229' ' ' LEU . . . . . . . . . . . . . 59.6 mt -63.42 -40.32 96.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.517 179.786 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 230' ' ' GLY . . . . . 0.438 ' O ' ' O ' ' B' ' 231' ' ' LEU . . . 78.88 -159.22 45.52 Favored Glycine 0 CA--C 1.524 0.597 0 N-CA-C 110.803 -0.919 . . . . 0.0 110.803 -179.955 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 231' ' ' LEU . . . . . 0.438 ' O ' ' O ' ' B' ' 230' ' ' GLY . 10.3 mp 56.3 156.75 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.06 0.457 . . . . 0.0 110.403 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 232' ' ' SER . . . . . . . . . . . . . 27.1 p -78.66 162.98 25.84 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.405 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 233' ' ' ASP . . . . . 0.536 ' C ' ' HD1' ' B' ' 235' ' ' HIS . 44.5 p-10 -130.93 148.4 52.69 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.448 179.907 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 234' ' ' ARG . . . . . 0.524 ' O ' ' CG ' ' B' ' 235' ' ' HIS . 85.0 mtp180 53.88 -87.47 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.551 -179.884 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 235' ' ' HIS . . . . . 0.536 ' HD1' ' C ' ' B' ' 233' ' ' ASP . 46.9 p-80 40.43 71.63 1.2 Allowed Pre-proline 0 N--CA 1.462 0.173 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.566 -179.796 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 236' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -58.31 144.0 96.61 Favored 'Trans proline' 0 C--N 1.305 -1.711 0 C-N-CA 122.757 2.305 . . . . 0.0 112.042 -179.693 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 237' ' ' SER . . . . . . . . . . . . . 68.1 m -60.68 -43.55 97.56 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.52 179.777 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 238' ' ' ALA . . . . . . . . . . . . . . . -69.73 146.19 51.7 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.583 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.725 0 CA-C-O 117.993 -1.448 . . . . 0.0 110.919 -179.985 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.316 0 N-CA-C 109.546 -1.421 . . . . 0.0 109.546 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 94.0 m-70 -61.75 -40.71 96.1 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.832 0.349 . . . . 0.0 110.65 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -64.24 -43.71 96.62 Favored Glycine 0 CA--C 1.523 0.556 0 N-CA-C 111.057 -0.817 . . . . 0.0 111.057 -179.845 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 14.6 p -142.63 142.71 26.48 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.255 0 CA-C-O 120.862 0.363 . . . . 0.0 110.527 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -59.64 142.46 52.86 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.292 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -47.0 159.54 0.37 Allowed Glycine 0 CA--C 1.522 0.469 0 N-CA-C 110.872 -0.891 . . . . 0.0 110.872 -179.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 80.1 mtp85 -82.79 128.27 34.24 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.7 0.286 . . . . 0.0 110.302 -179.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -103.73 5.01 35.9 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.656 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.592 ' N ' ' CD ' ' A' ' 11' ' ' PRO . 2.6 ttp85 -74.71 -44.55 5.3 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 116.287 -0.415 . . . . 0.0 109.944 179.792 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.592 ' CD ' ' N ' ' A' ' 10' ' ' ARG . 22.4 Cg_exo -63.16 146.82 94.39 Favored 'Trans proline' 0 C--N 1.308 -1.565 0 C-N-CA 122.816 2.344 . . . . 0.0 111.625 -179.748 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 40.5 m -149.04 152.42 36.2 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.321 179.475 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 64.07 70.92 0.63 Allowed Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.738 -179.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_exo -60.95 143.76 99.42 Favored 'Trans proline' 0 C--N 1.306 -1.669 0 C-N-CA 122.945 2.43 . . . . 0.0 111.802 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.546 ' O ' ' N ' ' A' ' 17' ' ' SER . 31.3 mt -82.73 115.42 21.65 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.972 179.776 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.506 ' O ' ' N ' ' A' ' 19' ' ' ALA . 19.1 t70 -41.02 -18.92 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.82 179.907 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.546 ' N ' ' O ' ' A' ' 15' ' ' LEU . 42.2 t -38.72 -42.33 0.79 Allowed 'General case' 0 C--O 1.241 0.657 0 CA-C-O 121.375 0.607 . . . . 0.0 110.381 -179.961 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 54.6 mt-30 -65.32 -43.3 91.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.164 179.022 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.506 ' N ' ' O ' ' A' ' 16' ' ' ASP . . . -62.61 -31.44 72.28 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.108 179.639 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.88 -53.27 53.21 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 179.683 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.37 -46.14 83.69 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.489 -0.484 . . . . 0.0 110.81 179.365 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 59.3 tt0 -56.1 -51.11 69.07 Favored 'General case' 0 C--O 1.242 0.668 0 CA-C-O 121.544 0.687 . . . . 0.0 110.38 -179.778 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 75.2 t -62.41 -43.31 98.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.753 179.558 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -49.39 -50.22 41.22 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.299 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 58.1 m -59.18 -42.34 90.59 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 91.2 m -63.31 -50.92 68.13 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 120.363 -0.535 . . . . 0.0 111.105 179.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 96.0 mt -68.35 -22.16 64.69 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.56 -179.739 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 49.5 tt0 -74.69 -58.0 3.57 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.281 179.559 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.6 -54.14 50.38 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.722 -0.391 . . . . 0.0 110.283 -179.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.496 ' O ' ' O ' ' A' ' 31' ' ' ALA . 77.1 mt -44.91 -33.14 1.86 Allowed 'General case' 0 CA--C 1.513 -0.481 0 C-N-CA 121.024 -0.27 . . . . 0.0 110.458 -179.198 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.496 ' O ' ' O ' ' A' ' 30' ' ' LEU . . . -57.61 -128.27 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.12 179.233 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.421 ' O ' ' O ' ' A' ' 31' ' ' ALA . 0.6 OUTLIER 54.26 107.18 0.03 OUTLIER Pre-proline 0 CA--C 1.54 0.579 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.571 -179.959 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -49.27 -58.68 1.6 Allowed 'Trans proline' 0 N--CA 1.496 1.663 0 C-N-CA 122.165 1.91 . . . . 0.0 113.429 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 78.4 p -55.54 -43.33 75.69 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.802 -179.149 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 44.4 ttm180 -61.06 -44.29 97.61 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 120.817 -0.353 . . . . 0.0 110.663 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 7.1 mt -61.03 -45.74 93.57 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.467 -0.493 . . . . 0.0 110.908 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.464 ' C ' ' SD ' ' A' ' 37' ' ' MET . 0.0 OUTLIER -55.21 -46.79 75.91 Favored 'General case' 0 C--N 1.319 -0.741 0 C-N-CA 120.15 -0.62 . . . . 0.0 110.163 -179.886 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.484 ' CD1' ' OE1' ' A' ' 66' ' ' GLN . 65.0 mt -63.72 -45.34 97.59 Favored 'Isoleucine or valine' 0 C--O 1.239 0.532 0 CA-C-O 121.601 0.715 . . . . 0.0 110.734 -179.824 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -63.28 -40.95 98.83 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.765 179.827 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.454 ' OG1' ' O ' ' A' ' 37' ' ' MET . 15.3 p -61.42 -37.34 83.15 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.944 179.974 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -62.1 -47.46 84.53 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.516 -0.474 . . . . 0.0 109.855 179.335 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 29.3 mt -64.54 -35.39 80.8 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.762 179.525 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 62.5 ttp180 -55.15 -31.94 61.73 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.57 -179.521 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 98.4 m-20 -61.15 -41.03 96.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.507 -179.647 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.42 ' O ' ' CD2' ' A' ' 47' ' ' LEU . . . 155.83 -160.38 29.96 Favored Glycine 0 CA--C 1.528 0.847 0 N-CA-C 110.951 -0.86 . . . . 0.0 110.951 180.0 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_exo -61.67 144.08 97.07 Favored 'Trans proline' 0 C--N 1.309 -1.528 0 C-N-CA 122.96 2.44 . . . . 0.0 111.976 179.499 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.42 ' CD2' ' O ' ' A' ' 45' ' ' GLY . 0.3 OUTLIER 176.95 94.21 0.12 Allowed Pre-proline 0 CA--C 1.538 0.507 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.353 179.706 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo -48.32 177.88 0.01 OUTLIER 'Trans proline' 0 C--N 1.297 -2.155 0 C-N-CA 122.282 1.988 . . . . 0.0 112.485 -179.737 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.48 ' CG2' ' N ' ' A' ' 50' ' ' THR . 4.7 m -59.97 -42.39 89.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 121.51 0.671 . . . . 0.0 110.367 -179.759 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.48 ' N ' ' CG2' ' A' ' 49' ' ' VAL . 11.1 m -59.87 -41.4 91.43 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.007 -0.997 . . . . 0.0 110.537 179.641 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -73.95 -46.58 43.21 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.702 179.57 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.2 tt -61.42 -45.52 93.97 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.586 -179.281 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.86 -46.33 78.85 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.666 -0.414 . . . . 0.0 111.281 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -55.61 -35.81 66.27 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.138 -179.429 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -50.96 -59.59 3.98 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.516 -0.473 . . . . 0.0 110.708 -179.291 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 2.2 pp -158.84 -18.17 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.605 -179.704 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -58.84 -64.78 3.98 Favored Glycine 0 CA--C 1.523 0.552 0 N-CA-C 111.209 -0.756 . . . . 0.0 111.209 -179.171 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.488 ' O ' ' SD ' ' A' ' 58' ' ' MET . 0.0 OUTLIER 67.73 40.45 2.45 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.713 0.292 . . . . 0.0 110.328 179.996 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.477 ' O ' ' N ' ' A' ' 61' ' ' SER . 72.1 tt0 -169.01 60.86 0.05 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 13.1 mt-30 -41.45 -23.12 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.766 -179.434 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.477 ' N ' ' O ' ' A' ' 59' ' ' GLU . 69.3 m -68.7 -43.34 76.24 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.917 179.923 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.418 ' H ' ' HG2' ' A' ' 59' ' ' GLU . . . -68.12 -30.5 69.66 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.628 -179.888 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 59.4 t -72.18 -51.59 29.27 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.294 0 C-N-CA 120.882 -0.327 . . . . 0.0 110.845 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 40.8 t -59.8 -42.28 93.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.33 -179.738 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -62.82 -51.21 67.92 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-O 120.986 0.422 . . . . 0.0 110.995 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.484 ' OE1' ' CD1' ' A' ' 38' ' ' ILE . 73.5 mt-30 -63.66 -36.87 85.27 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.055 0.455 . . . . 0.0 110.471 179.968 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 5.9 tt -62.1 -43.75 98.15 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.479 -179.76 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -62.97 -41.79 99.64 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.862 0.363 . . . . 0.0 110.434 179.459 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 75.5 t -61.52 -54.18 38.42 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.206 0 C-N-CA 119.88 -0.728 . . . . 0.0 110.134 -179.726 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 94.9 mt -62.31 -37.31 85.09 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.175 0.512 . . . . 0.0 109.851 -179.561 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 7.4 tmm_? -57.34 -38.82 74.71 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.454 -179.842 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 99.0 m-20 -62.07 -41.09 97.81 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.421 -179.823 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 7.2 mt -66.02 -39.11 89.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.242 -179.488 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 102.79 31.72 5.03 Favored Glycine 0 CA--C 1.525 0.678 0 N-CA-C 111.011 -0.836 . . . . 0.0 111.011 -179.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 83.9 mt -95.04 -15.7 23.26 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 120.751 0.31 . . . . 0.0 110.701 179.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 33.4 m -136.88 160.7 36.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.088 179.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 40.3 t -137.71 150.42 25.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.345 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -124.74 145.89 15.94 Favored Glycine 0 CA--C 1.52 0.397 0 N-CA-C 110.237 -1.145 . . . . 0.0 110.237 179.437 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -120.48 104.64 10.15 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 120.827 0.346 . . . . 0.0 110.469 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 60.1 ttp180 -77.44 125.91 30.07 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.984 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -138.15 148.27 44.74 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.267 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -43.84 -35.36 3.23 Favored Glycine 0 CA--C 1.521 0.417 0 N-CA-C 110.538 -1.025 . . . . 0.0 110.538 -179.707 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.439 ' O ' ' OG ' ' A' ' 84' ' ' SER . 8.5 tpm_? -70.99 -46.72 61.8 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.687 -0.405 . . . . 0.0 110.688 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' SER . . . . . 0.439 ' OG ' ' O ' ' A' ' 83' ' ' ARG . 3.2 m 176.24 176.8 0.26 Allowed 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 121.193 0.521 . . . . 0.0 109.709 -179.548 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 1.1 tp -102.72 122.6 55.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.567 178.745 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 78.8 t -101.95 129.79 52.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.173 179.055 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 -104.86 129.94 53.09 Favored 'General case' 0 CA--C 1.52 -0.181 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 50.7 m -149.24 171.38 16.58 Favored 'General case' 0 N--CA 1.462 0.151 0 N-CA-C 110.049 -0.352 . . . . 0.0 110.049 -179.685 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 17.7 mt -67.98 148.96 50.33 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.428 -179.304 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -52.01 -44.92 64.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.2 -179.582 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.532 ' OD2' ' CD2' ' A' ' 93' ' ' HIS . 13.2 t70 -147.44 -177.55 5.76 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.327 -179.97 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' THR . . . . . 0.489 ' H ' ' CG ' ' A' ' 91' ' ' ASP . 6.6 p -90.86 -13.46 33.65 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.576 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . 0.532 ' CD2' ' OD2' ' A' ' 91' ' ' ASP . 91.2 m-70 -48.74 -65.08 0.63 Allowed 'General case' 0 C--O 1.235 0.323 0 CA-C-O 120.809 0.337 . . . . 0.0 110.712 179.879 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 27.2 m -50.74 -38.79 17.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.062 -179.684 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.66 -41.07 97.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.338 179.778 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 64.6 tp60 -61.92 -45.72 92.46 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.866 -179.615 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 13.0 tp -59.4 -42.32 91.47 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.584 -0.446 . . . . 0.0 110.133 -179.257 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 92.7 mt -63.33 -40.23 96.73 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.149 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . 0.435 ' OD1' ' CE1' ' A' ' 103' ' ' TYR . 65.7 t0 -60.22 -42.58 95.49 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.201 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -67.09 -50.22 62.33 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.491 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -56.19 -43.28 78.3 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 179.621 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 4.6 mm -62.48 -43.69 98.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 C-N-CA 120.384 -0.526 . . . . 0.0 110.439 -179.735 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' TYR . . . . . 0.435 ' CE1' ' OD1' ' A' ' 99' ' ' ASP . 3.3 m-85 -58.87 -41.31 86.77 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.868 -179.942 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 68.7 t60 -65.8 -38.78 89.89 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.619 179.501 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 43.2 t -58.96 -46.32 88.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.24 -179.638 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -75.01 -58.05 3.52 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.008 0.432 . . . . 0.0 110.954 179.228 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 84.7 t60 -50.75 -34.46 27.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.725 -0.671 . . . . 0.0 109.735 -179.341 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 7.0 tp -152.64 104.24 2.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.484 179.432 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . 0.581 ' N ' ' ND1' ' A' ' 109' ' ' HIS . 0.0 OUTLIER -97.07 -74.58 0.57 Allowed 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.237 179.881 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.496 ' H ' ' CG ' ' A' ' 109' ' ' HIS . 4.3 mm? 49.0 11.63 0.04 OUTLIER 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.304 -179.714 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . 0.512 ' H ' ' C ' ' A' ' 109' ' ' HIS . . . -86.12 -3.31 85.18 Favored Glycine 0 CA--C 1.525 0.7 0 N-CA-C 110.914 -0.875 . . . . 0.0 110.914 179.86 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 81.6 mt -69.38 -17.08 63.64 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.993 0.425 . . . . 0.0 110.414 -179.508 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.492 ' OG ' ' N ' ' A' ' 114' ' ' ASP . 78.7 p -62.81 -69.35 0.27 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.552 -179.859 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . 0.492 ' N ' ' OG ' ' A' ' 113' ' ' SER . 62.6 t0 40.73 66.4 0.64 Allowed 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.779 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 20.6 mmm180 -62.83 -42.4 99.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.491 -179.558 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER 40.14 77.57 0.41 Allowed Pre-proline 0 C--N 1.331 -0.236 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.62 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_exo -56.15 141.12 87.9 Favored 'Trans proline' 0 C--N 1.307 -1.615 0 C-N-CA 122.647 2.231 . . . . 0.0 112.116 -179.628 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 39.5 t -62.48 -44.22 96.93 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.552 179.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . 46.58 -171.75 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.615 -179.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.774 0 CA-C-O 117.997 -1.446 . . . . 0.0 110.937 -179.865 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.393 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 94.8 m-70 -65.85 -39.79 91.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.76 0.314 . . . . 0.0 110.511 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 123' ' ' GLY . . . . . . . . . . . . . . . -64.17 -43.03 97.72 Favored Glycine 0 CA--C 1.524 0.638 0 N-CA-C 111.046 -0.821 . . . . 0.0 111.046 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 14.8 p -144.22 142.55 24.0 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.188 0 CA-C-O 120.829 0.347 . . . . 0.0 110.617 179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 125' ' ' GLU . . . . . . . . . . . . . 73.9 mm-40 -58.56 146.91 34.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.51 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -50.39 160.89 1.24 Allowed Glycine 0 CA--C 1.524 0.604 0 N-CA-C 110.774 -0.931 . . . . 0.0 110.774 -179.808 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 127' ' ' ARG . . . . . . . . . . . . . 80.7 mtp85 -86.82 126.39 34.6 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.905 0.383 . . . . 0.0 110.487 -179.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 128' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -103.12 2.74 35.03 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.637 179.8 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 129' ' ' ARG . . . . . 0.565 ' N ' ' CD ' ' B' ' 130' ' ' PRO . 1.8 ttp85 -68.76 -45.81 33.26 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.609 179.373 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 130' ' ' PRO . . . . . 0.565 ' CD ' ' N ' ' B' ' 129' ' ' ARG . 60.9 Cg_endo -79.24 143.85 17.9 Favored 'Trans proline' 0 C--N 1.31 -1.485 0 C-N-CA 122.531 2.154 . . . . 0.0 111.916 -178.651 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 66.6 m -142.83 162.43 35.48 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.477 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 132' ' ' ALA . . . . . . . . . . . . . . . 62.22 72.01 0.67 Allowed Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.577 -179.77 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 133' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -69.25 147.15 65.5 Favored 'Trans proline' 0 N--CA 1.492 1.418 0 C-N-CA 122.715 2.277 . . . . 0.0 111.846 -179.544 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . 0.54 ' O ' ' N ' ' B' ' 136' ' ' SER . 24.2 mt -80.47 119.7 23.5 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.232 -179.811 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 135' ' ' ASP . . . . . 0.498 ' O ' ' N ' ' B' ' 138' ' ' ALA . 20.3 t70 -41.94 -17.84 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.758 179.681 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 136' ' ' SER . . . . . 0.54 ' N ' ' O ' ' B' ' 134' ' ' LEU . 25.8 t -38.47 -42.05 0.71 Allowed 'General case' 0 C--O 1.242 0.659 0 CA-C-O 121.218 0.533 . . . . 0.0 110.484 -179.722 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 74.9 mt-30 -65.45 -43.59 89.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.041 179.146 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 138' ' ' ALA . . . . . 0.498 ' N ' ' O ' ' B' ' 135' ' ' ASP . . . -62.97 -31.34 72.43 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.211 179.729 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -64.12 -53.11 54.75 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 120.957 0.408 . . . . 0.0 109.901 179.677 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -57.63 -46.78 83.7 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.737 179.424 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -55.9 -50.02 71.83 Favored 'General case' 0 C--O 1.242 0.67 0 CA-C-O 121.563 0.697 . . . . 0.0 110.171 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 142' ' ' VAL . . . . . . . . . . . . . 77.7 t -62.61 -43.56 98.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.688 179.611 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -49.63 -49.27 47.73 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.418 179.888 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 55.2 m -59.17 -43.0 92.12 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.33 -0.395 . . . . 0.0 109.977 179.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 89.0 m -63.27 -50.39 70.33 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 120.386 -0.526 . . . . 0.0 110.995 179.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 96.0 mt -68.82 -22.78 64.22 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.799 -179.785 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 147' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -74.62 -57.63 3.8 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.402 179.483 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -58.63 -54.13 50.52 Favored 'General case' 0 CA--C 1.519 -0.227 0 C-N-CA 120.57 -0.452 . . . . 0.0 110.388 -179.579 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.501 ' O ' ' O ' ' B' ' 150' ' ' ALA . 77.5 mt -45.26 -33.53 2.42 Favored 'General case' 0 CA--C 1.513 -0.465 0 C-N-CA 121.021 -0.272 . . . . 0.0 110.441 -178.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 150' ' ' ALA . . . . . 0.501 ' O ' ' O ' ' B' ' 149' ' ' LEU . . . -57.1 -128.35 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.238 0.542 . . . . 0.0 110.309 179.363 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 151' ' ' THR . . . . . 0.433 ' O ' ' O ' ' B' ' 150' ' ' ALA . 0.6 OUTLIER 54.3 108.61 0.02 OUTLIER Pre-proline 0 CA--C 1.541 0.623 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.558 -179.722 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -49.73 -59.18 1.32 Allowed 'Trans proline' 0 N--CA 1.494 1.555 0 C-N-CA 122.197 1.931 . . . . 0.0 113.317 179.73 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 84.3 p -54.92 -43.96 73.78 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.812 -179.101 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 44.2 ttm180 -60.79 -44.43 96.84 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.574 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 155' ' ' LEU . . . . . . . . . . . . . 7.2 mt -60.92 -46.16 91.78 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.365 -0.534 . . . . 0.0 110.694 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 156' ' ' MET . . . . . 0.477 ' C ' ' SD ' ' B' ' 156' ' ' MET . 0.0 OUTLIER -54.58 -47.22 73.56 Favored 'General case' 0 C--N 1.318 -0.764 0 C-N-CA 120.116 -0.634 . . . . 0.0 110.131 -179.91 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 157' ' ' ILE . . . . . 0.452 ' CD1' ' OE1' ' B' ' 185' ' ' GLN . 67.4 mt -63.61 -45.78 96.64 Favored 'Isoleucine or valine' 0 C--O 1.239 0.544 0 CA-C-O 121.483 0.658 . . . . 0.0 110.808 -179.757 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -63.01 -40.45 97.81 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.866 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 159' ' ' THR . . . . . 0.477 ' OG1' ' O ' ' B' ' 156' ' ' MET . 18.1 p -61.22 -38.17 85.66 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 116.088 -0.505 . . . . 0.0 109.938 -180.0 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 14.4 mm100 -61.52 -47.29 86.27 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.549 -0.46 . . . . 0.0 109.923 179.395 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 161' ' ' LEU . . . . . . . . . . . . . 29.4 mt -64.71 -34.79 79.15 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.837 179.622 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 162' ' ' ARG . . . . . . . . . . . . . 62.6 ttp180 -56.3 -30.79 62.97 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.674 -179.46 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 98.1 m-20 -61.74 -41.1 97.21 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.462 -179.631 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 164' ' ' GLY . . . . . 0.427 ' O ' ' CD2' ' B' ' 166' ' ' LEU . . . 156.49 -160.44 30.22 Favored Glycine 0 CA--C 1.526 0.755 0 N-CA-C 110.887 -0.885 . . . . 0.0 110.887 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_exo -62.13 143.25 94.37 Favored 'Trans proline' 0 C--N 1.308 -1.556 0 C-N-CA 123.016 2.477 . . . . 0.0 112.024 179.434 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 166' ' ' LEU . . . . . 0.427 ' CD2' ' O ' ' B' ' 164' ' ' GLY . 0.3 OUTLIER 177.96 95.13 0.14 Allowed Pre-proline 0 CA--C 1.538 0.499 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.408 179.682 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_exo -48.51 177.94 0.02 OUTLIER 'Trans proline' 0 C--N 1.299 -2.075 0 C-N-CA 122.353 2.035 . . . . 0.0 112.377 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 168' ' ' VAL . . . . . 0.468 ' CG2' ' N ' ' B' ' 169' ' ' THR . 4.2 m -59.87 -42.36 88.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 121.589 0.709 . . . . 0.0 110.388 -179.728 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 169' ' ' THR . . . . . 0.468 ' N ' ' CG2' ' B' ' 168' ' ' VAL . 9.8 m -59.48 -40.84 88.29 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.454 179.902 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -74.11 -46.33 43.41 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.759 179.517 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 4.8 tt -61.64 -44.2 97.43 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.348 -178.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 172' ' ' ALA . . . . . . . . . . . . . . . -67.35 -46.94 71.91 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.131 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 82.3 tt0 -54.93 -36.38 65.2 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.219 -179.479 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -51.15 -59.6 4.01 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.463 -0.495 . . . . 0.0 110.821 -179.19 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 2.2 pp -159.08 -17.4 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.567 -179.493 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . -60.12 -64.17 4.4 Favored Glycine 0 CA--C 1.524 0.595 0 N-CA-C 111.112 -0.795 . . . . 0.0 111.112 -179.347 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 177' ' ' MET . . . . . 0.495 ' O ' ' SD ' ' B' ' 177' ' ' MET . 0.0 OUTLIER 66.71 40.78 3.16 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.707 0.289 . . . . 0.0 110.268 179.927 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 178' ' ' GLU . . . . . 0.49 ' O ' ' N ' ' B' ' 180' ' ' SER . 71.9 tt0 -168.33 60.41 0.06 Allowed 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 179.919 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 13.2 mt-30 -41.27 -22.82 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.766 -179.378 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 180' ' ' SER . . . . . 0.49 ' N ' ' O ' ' B' ' 178' ' ' GLU . 49.1 m -68.84 -43.85 74.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.99 179.831 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 181' ' ' ALA . . . . . 0.429 ' H ' ' HG2' ' B' ' 178' ' ' GLU . . . -68.02 -30.16 69.34 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.591 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 57.9 t -72.03 -51.66 29.49 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 C-N-CA 120.811 -0.356 . . . . 0.0 110.893 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 6.5 t -59.54 -42.61 92.73 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.255 -179.763 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -62.85 -50.69 69.95 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 120.931 0.396 . . . . 0.0 110.979 -179.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 185' ' ' GLN . . . . . 0.452 ' OE1' ' CD1' ' B' ' 157' ' ' ILE . 74.2 mt-30 -63.62 -36.72 84.75 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.533 179.915 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 5.8 tt -62.79 -44.07 97.14 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.662 -179.818 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -62.51 -41.78 99.06 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.413 179.607 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 76.8 t -61.66 -54.26 37.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 C-N-CA 119.881 -0.728 . . . . 0.0 110.174 -179.765 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 86.6 mt -62.26 -37.49 85.65 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.233 0.54 . . . . 0.0 109.954 -179.517 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 7.3 tmm_? -56.93 -40.07 75.67 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.454 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -61.33 -41.28 96.77 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.881 0.372 . . . . 0.0 110.325 -179.512 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 192' ' ' LEU . . . . . . . . . . . . . 7.3 mt -65.53 -38.89 90.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.398 -179.508 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 102.46 30.26 5.67 Favored Glycine 0 CA--C 1.524 0.633 0 N-CA-C 110.857 -0.897 . . . . 0.0 110.857 -179.844 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 94.6 mt -93.66 -16.37 24.37 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.85 0.357 . . . . 0.0 110.689 179.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 35.7 m -136.53 160.47 37.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.323 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 196' ' ' VAL . . . . . . . . . . . . . 42.8 t -138.42 152.38 25.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.159 179.783 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 197' ' ' GLY . . . . . . . . . . . . . . . -127.44 147.64 17.15 Favored Glycine 0 CA--C 1.523 0.565 0 N-CA-C 110.448 -1.061 . . . . 0.0 110.448 179.685 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -119.97 106.63 12.21 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 120.897 0.38 . . . . 0.0 110.524 179.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 59.7 ttp180 -79.88 123.43 27.75 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.191 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 200' ' ' ALA . . . . . . . . . . . . . . . -135.99 146.76 47.55 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.283 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 201' ' ' GLY . . . . . . . . . . . . . . . -42.43 -35.36 1.9 Allowed Glycine 0 CA--C 1.521 0.436 0 N-CA-C 110.671 -0.971 . . . . 0.0 110.671 -179.702 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 202' ' ' ARG . . . . . 0.439 ' O ' ' OG ' ' B' ' 203' ' ' SER . 8.1 tpm_? -70.38 -47.74 59.5 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.694 -0.402 . . . . 0.0 110.72 -179.991 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 203' ' ' SER . . . . . 0.439 ' OG ' ' O ' ' B' ' 202' ' ' ARG . 3.4 m 177.52 175.91 0.42 Allowed 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 121.092 0.472 . . . . 0.0 109.739 -179.576 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 1.2 tp -102.61 121.92 54.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.531 179.023 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 70.8 t -101.2 129.87 51.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 N-CA-C 109.959 -0.385 . . . . 0.0 109.959 179.046 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 -104.71 129.45 52.91 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 45.3 m -148.82 171.01 16.96 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 110.019 -0.363 . . . . 0.0 110.019 -179.627 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . 18.6 mt -68.41 149.78 48.93 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.454 -179.356 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 9.2 t80 -52.25 -46.44 65.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.316 -179.457 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 210' ' ' ASP . . . . . 0.541 ' CG ' ' H ' ' B' ' 211' ' ' THR . 19.0 t70 -146.17 -178.71 6.28 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.791 0.329 . . . . 0.0 110.295 -179.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 211' ' ' THR . . . . . 0.541 ' H ' ' CG ' ' B' ' 210' ' ' ASP . 30.7 p -88.5 -16.47 32.6 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.535 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 212' ' ' HIS . . . . . 0.523 ' CD2' ' OD2' ' B' ' 210' ' ' ASP . 84.2 m-70 -46.47 -65.44 0.55 Allowed 'General case' 0 C--O 1.235 0.312 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.868 -179.834 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 20.3 m -50.38 -38.42 15.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 121.016 0.436 . . . . 0.0 110.139 -179.561 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 214' ' ' ALA . . . . . . . . . . . . . . . -62.21 -40.93 97.74 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.215 179.754 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 68.0 tp60 -62.19 -46.05 90.66 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.871 -179.541 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 216' ' ' LEU . . . . . . . . . . . . . 14.5 tp -59.0 -42.97 91.37 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.003 -179.138 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 88.5 mt -62.8 -40.59 97.83 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.206 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 67.1 t0 -59.37 -43.79 92.83 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.333 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 219' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -66.43 -49.8 65.54 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.438 -0.347 . . . . 0.0 110.547 179.541 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -56.3 -43.02 78.5 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.855 -0.424 . . . . 0.0 109.855 179.496 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 4.2 mm -62.68 -43.55 98.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 C-N-CA 120.39 -0.524 . . . . 0.0 110.463 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -59.09 -41.3 87.72 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.797 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 223' ' ' HIS . . . . . . . . . . . . . 58.8 t60 -65.84 -37.93 87.53 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.471 179.504 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 6.7 t -58.92 -46.99 86.62 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.389 -179.747 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -75.39 -56.69 4.46 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 121.005 0.431 . . . . 0.0 110.898 179.309 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -50.97 -34.7 30.04 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.864 -179.441 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 227' ' ' LEU . . . . . . . . . . . . . 7.1 tp -152.78 100.94 2.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.641 179.544 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 228' ' ' HIS . . . . . 0.577 ' ND1' ' N ' ' B' ' 228' ' ' HIS . 0.0 OUTLIER -93.15 -75.77 0.49 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.062 179.677 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 229' ' ' LEU . . . . . 0.546 ' H ' ' CG ' ' B' ' 228' ' ' HIS . 4.4 mm? 49.96 9.46 0.04 OUTLIER 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.409 -179.857 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 230' ' ' GLY . . . . . 0.548 ' H ' ' C ' ' B' ' 228' ' ' HIS . . . -84.0 -3.02 89.39 Favored Glycine 0 CA--C 1.524 0.603 0 N-CA-C 110.808 -0.917 . . . . 0.0 110.808 179.883 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 231' ' ' LEU . . . . . . . . . . . . . 83.9 mt -69.13 -18.11 63.92 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.842 0.353 . . . . 0.0 110.492 -179.607 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 232' ' ' SER . . . . . 0.522 ' OG ' ' N ' ' B' ' 233' ' ' ASP . 54.8 p -60.7 -69.53 0.22 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.568 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 233' ' ' ASP . . . . . 0.522 ' N ' ' OG ' ' B' ' 232' ' ' SER . 57.1 t0 40.55 64.86 0.86 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.8 179.958 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 234' ' ' ARG . . . . . . . . . . . . . 20.9 mmm180 -62.61 -42.43 99.57 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.391 -179.434 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 235' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER 39.99 77.86 0.4 Allowed Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.668 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 236' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -56.63 141.83 91.08 Favored 'Trans proline' 0 C--N 1.307 -1.645 0 C-N-CA 122.691 2.26 . . . . 0.0 112.021 -179.671 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 237' ' ' SER . . . . . . . . . . . . . 37.0 t -63.17 -43.58 97.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.644 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 238' ' ' ALA . . . . . . . . . . . . . . . 45.78 -169.2 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.523 -179.84 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.745 0 CA-C-O 118.061 -1.411 . . . . 0.0 110.9 -179.98 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.248 0 N-CA-C 109.605 -1.398 . . . . 0.0 109.605 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 80.7 m80 -93.67 122.49 36.18 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 120.886 0.374 . . . . 0.0 110.506 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -168.05 158.74 31.68 Favored Glycine 0 CA--C 1.526 0.725 0 N-CA-C 110.936 -0.866 . . . . 0.0 110.936 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 27.5 m -71.9 -22.17 21.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 121.052 0.453 . . . . 0.0 110.682 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.417 ' CD ' ' N ' ' A' ' 7' ' ' GLY . 10.1 tm-20 62.69 137.26 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.379 -179.813 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . 0.417 ' N ' ' CD ' ' A' ' 6' ' ' GLU . . . 78.39 18.76 75.44 Favored Glycine 0 CA--C 1.524 0.614 0 N-CA-C 110.918 -0.873 . . . . 0.0 110.918 179.933 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 52.5 ptt85 -75.52 144.5 41.94 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.808 0.337 . . . . 0.0 110.306 179.863 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -131.47 125.05 31.5 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.303 179.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 56.3 mtp180 -85.82 149.14 50.21 Favored Pre-proline 0 CA--C 1.533 0.318 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.628 -179.777 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -69.94 65.31 1.9 Allowed 'Trans proline' 0 N--CA 1.495 1.587 0 C-N-CA 122.591 2.194 . . . . 0.0 111.944 179.357 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 21.1 m -71.24 145.68 49.47 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.999 0.428 . . . . 0.0 110.292 179.88 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.452 ' CB ' ' CD ' ' A' ' 14' ' ' PRO . . . 55.4 179.99 0.03 OUTLIER Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.702 179.748 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.452 ' CD ' ' CB ' ' A' ' 13' ' ' ALA . 24.7 Cg_exo -62.28 163.58 19.92 Favored 'Trans proline' 0 N--CA 1.494 1.527 0 C-N-CA 122.902 2.402 . . . . 0.0 111.804 179.016 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.715 ' H ' ' CD2' ' A' ' 15' ' ' LEU . 0.4 OUTLIER -72.2 55.84 0.33 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.678 -179.876 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -96.07 -60.08 1.71 Allowed 'General case' 0 C--O 1.235 0.332 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.555 179.431 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 98.5 p -58.25 -33.48 69.41 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.459 -179.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -67.19 -49.41 64.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.501 179.428 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -56.81 -36.79 70.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.165 -179.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.31 -53.31 37.96 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.407 179.565 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.06 -44.95 94.35 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.952 -179.716 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -58.9 -50.65 73.24 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.255 0.55 . . . . 0.0 110.339 -179.806 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 70.9 t -62.1 -44.4 98.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.94 179.562 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.27 -43.13 82.8 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.137 179.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 66.2 m -57.56 -43.51 84.56 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 179.793 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 21.4 m -64.22 -49.06 73.46 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.631 -0.428 . . . . 0.0 110.685 179.207 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 85.9 mt -63.42 -22.53 66.94 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.442 -179.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 57.6 tt0 -75.33 -57.98 3.56 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.654 179.42 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.21 -54.54 44.55 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.932 -179.391 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.549 ' O ' ' O ' ' A' ' 31' ' ' ALA . 3.9 mm? -48.74 -30.4 5.56 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 -178.962 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.549 ' O ' ' O ' ' A' ' 30' ' ' LEU . . . -56.54 -133.95 0.0 OUTLIER 'General case' 0 C--O 1.22 -0.498 0 C-N-CA 120.366 -0.534 . . . . 0.0 110.362 179.102 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.519 ' HG1' ' C ' ' A' ' 31' ' ' ALA . 17.7 p 53.85 114.76 0.01 OUTLIER Pre-proline 0 CA--C 1.543 0.679 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.867 -179.807 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_exo -48.76 -44.54 31.1 Favored 'Trans proline' 0 N--CA 1.498 1.754 0 C-N-CA 122.229 1.953 . . . . 0.0 113.026 -179.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 39.5 t -59.92 -45.46 92.49 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.959 -178.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 15.7 tpp180 -63.4 -36.47 83.82 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.388 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.451 ' CD2' ' O ' ' A' ' 30' ' ' LEU . 1.6 mm? -63.15 -54.38 38.66 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.414 -0.514 . . . . 0.0 110.763 -179.181 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.461 ' O ' ' OG1' ' A' ' 40' ' ' THR . 0.0 OUTLIER -57.18 -49.23 76.61 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.008 -0.677 . . . . 0.0 110.639 -179.396 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 36.6 mm -62.62 -42.75 97.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-O 121.193 0.521 . . . . 0.0 110.383 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 42.6 tp -62.38 -43.03 99.77 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.785 -179.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.461 ' OG1' ' O ' ' A' ' 37' ' ' MET . 19.7 p -60.71 -35.88 77.43 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.305 -0.407 . . . . 0.0 109.997 -179.446 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -63.46 -45.85 88.91 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.274 -0.571 . . . . 0.0 110.108 178.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 98.1 mt -64.94 -42.54 94.55 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.951 179.701 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.532 ' NH1' ' OD1' ' A' ' 99' ' ' ASP . 68.7 ttp85 -52.04 -17.76 1.16 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.428 -179.9 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -75.91 -76.91 0.14 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.908 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -174.45 -143.67 4.51 Favored Glycine 0 CA--C 1.532 1.131 0 C-N-CA 120.539 -0.839 . . . . 0.0 111.217 -179.509 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -50.16 133.08 34.99 Favored 'Trans proline' 0 N--CA 1.493 1.464 0 C-N-CA 122.328 2.019 . . . . 0.0 112.184 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -136.68 66.79 57.53 Favored Pre-proline 0 CA--C 1.536 0.43 0 CA-C-O 121.547 0.689 . . . . 0.0 111.207 -179.941 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -51.61 148.51 20.85 Favored 'Trans proline' 0 C--N 1.299 -2.028 0 C-N-CA 121.852 1.701 . . . . 0.0 111.343 178.185 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 44.4 t -53.32 -51.4 41.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 121.253 0.549 . . . . 0.0 110.574 -178.377 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 48.4 p -62.92 -38.53 91.33 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.529 179.336 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -63.71 -41.39 98.11 Favored 'General case' 0 CA--C 1.514 -0.404 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.933 179.287 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.467 ' C ' ' CD1' ' A' ' 52' ' ' LEU . 2.8 tm? -61.58 -47.69 84.33 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 119.675 -0.81 . . . . 0.0 110.11 -179.492 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.515 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -52.69 -47.23 67.38 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.006 179.632 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 45.1 tp10 -54.85 -48.09 73.33 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.516 -0.474 . . . . 0.0 110.35 179.751 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -57.31 -54.0 51.71 Favored 'General case' 0 C--O 1.232 0.138 0 C-N-CA 120.493 -0.483 . . . . 0.0 111.012 -179.589 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.401 HD13 HG22 ' A' ' 56' ' ' ILE . 96.6 mt -89.08 -75.02 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.241 179.71 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . 0.515 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 133.02 96.97 0.63 Allowed Glycine 0 CA--C 1.522 0.513 0 N-CA-C 111.391 -0.684 . . . . 0.0 111.391 179.858 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 78.3 mtm 58.32 77.58 0.29 Allowed 'General case' 0 C--O 1.232 0.155 0 C-N-CA 120.974 -0.29 . . . . 0.0 110.878 179.117 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -173.33 32.63 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.25 0.548 . . . . 0.0 110.083 179.733 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.572 ' H ' ' CD ' ' A' ' 60' ' ' GLN . 0.0 OUTLIER -82.72 -25.06 33.27 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.612 -179.162 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.512 ' O ' ' ND1' ' A' ' 65' ' ' HIS . 73.1 m -65.82 -42.94 90.0 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.395 -179.917 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.56 -36.8 76.67 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.506 179.754 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 55.1 t -69.78 -52.24 33.39 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.3 0 C-N-CA 120.495 -0.482 . . . . 0.0 110.802 179.759 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 11.7 t -60.44 -44.58 95.67 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.234 -0.587 . . . . 0.0 110.51 179.691 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . 0.562 ' CG ' HH21 ' A' ' 68' ' ' ARG . 0.9 OUTLIER -57.03 -47.54 80.67 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.41 -179.844 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 81.6 mt-30 -59.51 -41.53 90.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.86 0.362 . . . . 0.0 110.836 179.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -61.31 -44.14 97.71 Favored 'General case' 0 CA--C 1.513 -0.457 0 C-N-CA 120.616 -0.434 . . . . 0.0 110.56 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.562 HH21 ' CG ' ' A' ' 65' ' ' HIS . 88.2 mtm180 -61.61 -40.82 96.2 Favored 'General case' 0 C--N 1.312 -1.035 0 C-N-CA 120.402 -0.519 . . . . 0.0 110.62 179.777 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 94.8 t -58.83 -52.31 61.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 -179.463 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 9.9 mp -67.06 -31.46 71.99 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.854 0.359 . . . . 0.0 110.282 179.042 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.657 HH12 ' N ' ' A' ' 78' ' ' GLY . 9.2 tpt180 -54.65 -43.83 72.69 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.881 -179.169 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -60.8 -43.59 97.96 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.329 -0.548 . . . . 0.0 110.38 179.87 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 10.0 mt -64.91 -38.92 92.59 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.024 0.44 . . . . 0.0 110.537 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 99.29 35.91 4.57 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 110.96 -0.856 . . . . 0.0 110.96 -179.722 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 85.0 mt -99.29 -19.03 17.28 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.746 0.307 . . . . 0.0 110.889 179.818 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 15.8 m -134.55 157.8 41.45 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.247 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.173 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.408 ' CG1' ' N ' ' A' ' 78' ' ' GLY . 70.8 t -136.8 156.83 35.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.302 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . 0.657 ' N ' HH12 ' A' ' 71' ' ' ARG . . . -133.29 132.74 6.64 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.856 -0.898 . . . . 0.0 110.856 179.344 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -104.86 102.7 12.22 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.891 0.377 . . . . 0.0 110.467 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.701 ' HE ' ' H ' ' A' ' 80' ' ' ARG . 0.0 OUTLIER -74.27 139.43 44.28 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.197 179.52 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -150.93 145.07 25.36 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.385 178.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -43.2 -32.28 1.61 Allowed Glycine 0 CA--C 1.522 0.511 0 N-CA-C 110.638 -0.985 . . . . 0.0 110.638 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.455 ' O ' ' OG ' ' A' ' 84' ' ' SER . 71.6 ttt180 -73.52 -46.9 45.0 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.89 -0.324 . . . . 0.0 110.783 179.619 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' SER . . . . . 0.455 ' OG ' ' O ' ' A' ' 83' ' ' ARG . 4.1 m 178.09 178.66 0.35 Allowed 'General case' 0 C--O 1.234 0.274 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 -179.153 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 1.4 tp -105.36 127.47 60.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.657 178.907 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 97.9 t -102.81 118.52 49.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.414 179.043 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 87.0 m-85 -95.52 127.58 41.67 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.38 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 34.5 p -150.15 165.72 32.0 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 116.195 -0.457 . . . . 0.0 109.867 -179.038 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.553 ' CD2' ' N ' ' A' ' 89' ' ' LEU . 2.5 mm? -67.82 146.52 53.61 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.561 -179.093 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.473 ' C ' ' CD1' ' A' ' 90' ' ' TYR . 16.4 t80 -58.27 -50.03 75.03 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.446 -179.515 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.527 ' OD1' ' N ' ' A' ' 92' ' ' THR . 53.7 t0 -101.0 155.6 17.88 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.473 -179.644 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' THR . . . . . 0.527 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 62.8 p -92.99 -24.34 18.39 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 121.104 0.478 . . . . 0.0 110.576 179.503 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -57.47 -47.94 80.52 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.221 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 8.0 p -55.05 -44.78 75.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.243 -0.435 . . . . 0.0 109.857 -179.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -56.0 -41.94 75.64 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.039 179.638 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 9.4 tp-100 -61.74 -39.49 91.76 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.071 179.616 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 13.5 tp -60.36 -43.51 96.44 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.153 -0.476 . . . . 0.0 109.92 -179.597 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -64.25 -37.18 86.57 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.302 179.251 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . 0.532 ' OD1' ' NH1' ' A' ' 43' ' ' ARG . 97.2 m-20 -60.65 -39.89 90.0 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.186 0.517 . . . . 0.0 110.378 179.861 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -72.78 -47.24 48.33 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.391 -0.524 . . . . 0.0 110.653 179.4 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -62.66 -50.94 69.21 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.042 -179.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . 0.52 ' CG2' ' N ' ' A' ' 103' ' ' TYR . 10.7 tp -59.21 -47.13 91.34 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.412 -178.673 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' TYR . . . . . 0.52 ' N ' ' CG2' ' A' ' 102' ' ' ILE . 79.5 t80 -60.54 -39.55 88.31 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.275 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . 0.482 ' CE1' ' OD2' ' B' ' 210' ' ' ASP . 0.9 OUTLIER -61.19 -41.66 97.19 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.728 179.601 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 33.3 t -73.56 -38.68 65.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.808 179.645 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . 0.514 ' O ' ' CD2' ' A' ' 109' ' ' HIS . 83.7 tt0 -64.78 -34.58 78.67 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.637 -179.508 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 74.6 t60 -79.27 0.81 27.2 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.66 -179.807 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 36.4 tp -80.09 82.57 6.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.003 0.43 . . . . 0.0 110.399 -179.501 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . 0.514 ' CD2' ' O ' ' A' ' 106' ' ' GLU . 97.0 m-70 -139.54 148.29 42.38 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.653 179.718 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.415 ' CD1' ' N ' ' A' ' 110' ' ' LEU . 10.7 mp -62.35 -41.86 98.93 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.369 -179.843 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 90.88 92.44 1.3 Allowed Glycine 0 CA--C 1.524 0.649 0 N-CA-C 110.796 -0.921 . . . . 0.0 110.796 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 70.2 mt -74.34 151.97 39.67 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.811 0.339 . . . . 0.0 110.373 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 11.9 p -65.38 154.44 38.38 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.254 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -92.5 107.12 18.97 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.409 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 90.9 mtm-85 -89.92 144.34 26.01 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.382 179.792 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -153.64 70.57 6.64 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.423 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -52.78 -39.9 76.01 Favored 'Trans proline' 0 C--N 1.308 -1.591 0 C-N-CA 122.747 2.298 . . . . 0.0 112.0 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 32.4 t 55.19 64.64 1.72 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.593 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -64.33 -37.21 86.68 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.514 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.717 0 CA-C-O 117.937 -1.48 . . . . 0.0 110.981 -179.987 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.372 0 N-CA-C 109.656 -1.378 . . . . 0.0 109.656 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 78.6 m80 -102.18 123.17 45.56 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.894 0.378 . . . . 0.0 110.434 -179.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 123' ' ' GLY . . . . . . . . . . . . . . . -168.9 159.89 33.14 Favored Glycine 0 CA--C 1.524 0.609 0 N-CA-C 110.863 -0.895 . . . . 0.0 110.863 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 26.1 m -72.12 -23.57 21.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.991 0.424 . . . . 0.0 110.767 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 125' ' ' GLU . . . . . . . . . . . . . 9.7 tm-20 64.23 136.0 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.553 -179.806 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 79.22 18.58 73.98 Favored Glycine 0 CA--C 1.525 0.667 0 N-CA-C 110.885 -0.886 . . . . 0.0 110.885 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 127' ' ' ARG . . . . . . . . . . . . . 52.3 ptt85 -75.62 145.16 41.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.706 0.289 . . . . 0.0 110.528 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 128' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -131.98 127.01 35.39 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.935 0.398 . . . . 0.0 110.322 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 129' ' ' ARG . . . . . . . . . . . . . 56.5 mtp180 -87.67 149.17 45.62 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.593 -179.778 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -70.27 64.79 2.11 Favored 'Trans proline' 0 N--CA 1.495 1.616 0 C-N-CA 122.531 2.154 . . . . 0.0 111.948 179.526 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 33.7 m -71.5 146.42 48.55 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.171 179.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 132' ' ' ALA . . . . . 0.44 ' CB ' ' CD ' ' B' ' 133' ' ' PRO . . . 56.3 179.43 0.03 OUTLIER Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.667 179.764 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 133' ' ' PRO . . . . . 0.44 ' CD ' ' CB ' ' B' ' 132' ' ' ALA . 24.1 Cg_exo -62.91 161.83 27.88 Favored 'Trans proline' 0 N--CA 1.492 1.405 0 C-N-CA 123.013 2.475 . . . . 0.0 111.658 178.848 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . 0.711 ' CD2' ' H ' ' B' ' 134' ' ' LEU . 0.4 OUTLIER -70.6 55.9 0.17 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.781 -179.802 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 95.1 m-20 -96.33 -59.06 1.91 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.679 -0.692 . . . . 0.0 110.384 179.407 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 90.9 p -58.81 -34.13 71.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.39 -179.633 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -67.05 -49.04 66.46 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.377 179.582 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 138' ' ' ALA . . . . . . . . . . . . . . . -56.87 -36.76 70.44 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 120.845 -0.342 . . . . 0.0 110.232 -179.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -66.22 -53.41 37.47 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.498 179.415 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -59.75 -46.02 90.43 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.907 -179.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 65.2 tt0 -58.14 -51.08 71.19 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.278 0.561 . . . . 0.0 110.385 -179.777 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 142' ' ' VAL . . . . . . . . . . . . . 70.8 t -61.66 -44.96 99.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.992 179.703 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -57.36 -42.6 82.34 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 74.9 m -57.36 -44.11 84.09 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 179.823 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 19.7 m -63.99 -48.52 76.09 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.639 179.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 80.3 mt -63.69 -22.55 66.96 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.498 -179.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 147' ' ' GLN . . . . . . . . . . . . . 58.8 tt0 -75.21 -58.43 3.28 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.679 179.374 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -59.96 -54.32 47.51 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.91 -179.308 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.551 ' O ' ' O ' ' B' ' 150' ' ' ALA . 3.9 mm? -48.65 -30.89 5.95 Favored 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 -179.076 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 150' ' ' ALA . . . . . 0.551 ' O ' ' O ' ' B' ' 149' ' ' LEU . . . -56.37 -134.47 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 120.465 -0.494 . . . . 0.0 110.52 179.175 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 151' ' ' THR . . . . . 0.493 ' O ' ' O ' ' B' ' 150' ' ' ALA . 12.3 p 53.62 115.83 0.01 OUTLIER Pre-proline 0 C--N 1.32 -0.677 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.779 -179.804 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_exo -49.07 -44.27 33.47 Favored 'Trans proline' 0 N--CA 1.497 1.701 0 C-N-CA 122.118 1.879 . . . . 0.0 112.991 -179.742 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 6.9 t -59.11 -46.21 88.9 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.94 -178.859 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 154' ' ' ARG . . . . . 0.488 ' CB ' ' HG1' ' B' ' 151' ' ' THR . 16.0 tpp180 -62.96 -36.8 84.67 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.425 -179.715 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 155' ' ' LEU . . . . . 0.437 ' CD2' ' O ' ' B' ' 149' ' ' LEU . 1.9 mm? -62.88 -54.11 43.81 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.384 -0.526 . . . . 0.0 110.821 -179.09 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 156' ' ' MET . . . . . 0.455 ' O ' ' OG1' ' B' ' 159' ' ' THR . 0.0 OUTLIER -57.72 -49.34 76.89 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.063 -0.655 . . . . 0.0 110.614 -179.416 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 39.0 mm -62.63 -42.71 97.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-O 121.218 0.533 . . . . 0.0 110.337 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 48.6 tp -62.22 -43.03 99.74 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.769 -179.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 159' ' ' THR . . . . . 0.455 ' OG1' ' O ' ' B' ' 156' ' ' MET . 23.4 p -60.52 -37.08 80.0 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.913 -0.403 . . . . 0.0 109.913 -179.455 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 75.7 mt-30 -62.71 -46.13 89.57 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.256 -0.577 . . . . 0.0 110.037 179.142 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 161' ' ' LEU . . . . . . . . . . . . . 98.2 mt -64.79 -42.87 94.72 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 120.786 -0.365 . . . . 0.0 110.908 179.63 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 162' ' ' ARG . . . . . 0.525 ' NH1' ' OD1' ' B' ' 218' ' ' ASP . 68.4 ttp85 -51.73 -18.24 1.17 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.395 -179.799 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 61.1 t30 -75.26 -75.05 0.18 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.676 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . -178.42 -141.99 4.55 Favored Glycine 0 CA--C 1.534 1.225 0 C-N-CA 120.487 -0.863 . . . . 0.0 111.199 -179.65 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -49.25 132.77 29.22 Favored 'Trans proline' 0 N--CA 1.493 1.477 0 C-N-CA 122.149 1.899 . . . . 0.0 112.338 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -138.3 67.48 46.37 Favored Pre-proline 0 CA--C 1.536 0.416 0 CA-C-O 121.558 0.694 . . . . 0.0 111.362 -179.856 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -51.97 147.93 24.79 Favored 'Trans proline' 0 C--N 1.298 -2.082 0 C-N-CA 121.772 1.648 . . . . 0.0 111.347 178.24 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . 22.1 t -53.17 -50.39 46.46 Favored 'Isoleucine or valine' 0 C--O 1.237 0.417 0 CA-C-O 121.162 0.505 . . . . 0.0 110.556 -178.296 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 169' ' ' THR . . . . . . . . . . . . . 59.1 p -63.97 -37.8 88.73 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.477 179.274 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -63.57 -41.2 98.4 Favored 'General case' 0 CA--C 1.513 -0.455 0 CA-C-O 121.249 0.547 . . . . 0.0 109.987 179.191 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 171' ' ' LEU . . . . . 0.45 ' C ' ' CD1' ' B' ' 171' ' ' LEU . 2.8 tm? -61.95 -46.83 87.58 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 119.706 -0.798 . . . . 0.0 109.96 -179.628 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 172' ' ' ALA . . . . . 0.513 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -52.49 -47.85 66.31 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 120.558 -0.457 . . . . 0.0 109.955 179.441 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 44.7 tp10 -54.81 -48.5 72.7 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.425 -0.51 . . . . 0.0 110.531 179.669 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -56.32 -54.93 39.59 Favored 'General case' 0 C--O 1.232 0.157 0 C-N-CA 120.581 -0.448 . . . . 0.0 110.959 -179.352 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 175' ' ' ILE . . . . . 0.409 HD13 HG22 ' B' ' 175' ' ' ILE . 96.3 mt -88.89 -73.91 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.398 179.706 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 176' ' ' GLY . . . . . 0.513 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 132.24 97.53 0.69 Allowed Glycine 0 CA--C 1.523 0.534 0 N-CA-C 111.405 -0.678 . . . . 0.0 111.405 179.824 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 78.3 mtm 58.09 78.06 0.26 Allowed 'General case' 0 CA--C 1.521 -0.148 0 C-N-CA 121.04 -0.264 . . . . 0.0 110.947 179.141 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -174.19 32.23 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.02 0.438 . . . . 0.0 110.115 179.676 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 179' ' ' GLN . . . . . 0.54 ' H ' ' CD ' ' B' ' 179' ' ' GLN . 0.0 OUTLIER -82.21 -25.68 33.98 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.514 -179.017 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 180' ' ' SER . . . . . 0.526 ' O ' ' ND1' ' B' ' 184' ' ' HIS . 34.3 m -65.49 -42.98 91.57 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.589 -179.916 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -69.0 -36.91 78.34 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.633 179.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 54.5 t -69.8 -51.84 36.97 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.279 0 C-N-CA 120.501 -0.48 . . . . 0.0 110.785 179.791 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 48.0 t -60.05 -44.94 94.33 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.277 -0.569 . . . . 0.0 110.583 179.606 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 184' ' ' HIS . . . . . 0.572 ' CG ' HH21 ' B' ' 187' ' ' ARG . 0.9 OUTLIER -56.92 -47.61 80.19 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.395 -179.797 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -58.42 -43.07 88.51 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.967 179.699 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -60.53 -43.96 96.58 Favored 'General case' 0 CA--C 1.511 -0.535 0 C-N-CA 120.646 -0.421 . . . . 0.0 110.558 -179.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 187' ' ' ARG . . . . . 0.572 HH21 ' CG ' ' B' ' 184' ' ' HIS . 86.9 mtm180 -61.32 -40.65 94.98 Favored 'General case' 0 C--N 1.312 -1.043 0 C-N-CA 120.46 -0.496 . . . . 0.0 110.463 -180.0 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 97.3 t -59.15 -52.36 61.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 C-N-CA 120.352 -0.539 . . . . 0.0 109.701 -179.533 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 10.9 mp -67.18 -31.81 72.46 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.954 0.407 . . . . 0.0 110.341 179.078 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 190' ' ' ARG . . . . . 0.656 HH12 ' N ' ' B' ' 197' ' ' GLY . 9.6 tpt180 -54.44 -43.49 71.65 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.867 -179.137 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 10.9 m120 -61.0 -43.59 98.67 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.329 -0.549 . . . . 0.0 110.283 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 192' ' ' LEU . . . . . . . . . . . . . 10.7 mt -64.75 -39.09 93.05 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.948 0.404 . . . . 0.0 110.359 179.815 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 99.12 35.43 4.78 Favored Glycine 0 CA--C 1.524 0.621 0 N-CA-C 111.056 -0.818 . . . . 0.0 111.056 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 17.5 mt -98.7 -18.43 18.04 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.866 0.365 . . . . 0.0 110.773 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 14.1 m -134.39 157.75 41.6 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.268 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.003 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 196' ' ' VAL . . . . . 0.437 ' CG1' ' N ' ' B' ' 197' ' ' GLY . 60.8 t -137.98 158.06 32.77 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.239 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.265 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 197' ' ' GLY . . . . . 0.656 ' N ' HH12 ' B' ' 190' ' ' ARG . . . -135.75 132.69 6.27 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 179.37 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 9.7 t0 -103.47 103.87 13.89 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.865 0.364 . . . . 0.0 110.572 179.763 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 199' ' ' ARG . . . . . 0.678 ' HE ' ' H ' ' B' ' 199' ' ' ARG . 0.0 OUTLIER -74.12 139.8 44.8 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.955 179.46 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 200' ' ' ALA . . . . . . . . . . . . . . . -151.09 144.46 24.84 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 120.566 -0.454 . . . . 0.0 110.338 178.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 201' ' ' GLY . . . . . . . . . . . . . . . -42.84 -33.22 1.58 Allowed Glycine 0 CA--C 1.524 0.597 0 N-CA-C 110.589 -1.004 . . . . 0.0 110.589 -179.805 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 202' ' ' ARG . . . . . 0.436 ' O ' ' OG ' ' B' ' 203' ' ' SER . 72.8 ttt180 -72.7 -46.28 54.5 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.696 179.76 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 203' ' ' SER . . . . . 0.436 ' OG ' ' O ' ' B' ' 202' ' ' ARG . 3.5 m 177.6 178.76 0.3 Allowed 'General case' 0 N--CA 1.455 -0.222 0 CA-C-O 121.06 0.457 . . . . 0.0 109.854 -179.077 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 1.4 tp -105.97 126.75 61.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.58 179.094 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 89.2 t -102.14 118.5 49.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.41 178.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 89.9 m-85 -94.98 127.74 41.26 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.384 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 30.4 p -150.33 165.53 32.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.879 -179.042 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 208' ' ' LEU . . . . . 0.554 ' CD2' ' N ' ' B' ' 208' ' ' LEU . 2.6 mm? -67.3 147.84 52.45 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.898 -179.186 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 209' ' ' TYR . . . . . 0.469 ' C ' ' CD1' ' B' ' 209' ' ' TYR . 17.0 t80 -59.05 -49.22 78.73 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.405 -179.662 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 210' ' ' ASP . . . . . 0.529 ' OD1' ' N ' ' B' ' 211' ' ' THR . 53.5 t0 -102.63 155.7 18.12 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.602 -179.596 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 211' ' ' THR . . . . . 0.529 ' N ' ' OD1' ' B' ' 210' ' ' ASP . 23.8 p -92.78 -24.24 18.61 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.005 0.431 . . . . 0.0 110.348 179.629 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 212' ' ' HIS . . . . . . . . . . . . . 88.3 m-70 -57.15 -48.14 79.43 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.204 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 213' ' ' VAL . . . . . 0.409 ' CG1' ' N ' ' B' ' 214' ' ' ALA . 9.6 p -55.35 -44.93 77.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 N-CA-C 109.862 -0.422 . . . . 0.0 109.862 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 214' ' ' ALA . . . . . 0.409 ' N ' ' CG1' ' B' ' 213' ' ' VAL . . . -54.98 -42.86 72.96 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.186 179.583 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 9.6 tp-100 -61.68 -39.67 92.26 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.093 179.545 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 216' ' ' LEU . . . . . . . . . . . . . 15.2 tp -59.89 -43.36 94.85 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.585 -0.446 . . . . 0.0 109.883 -179.489 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -64.32 -37.73 88.53 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.408 179.193 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 218' ' ' ASP . . . . . 0.525 ' OD1' ' NH1' ' B' ' 162' ' ' ARG . 98.6 m-20 -60.44 -39.78 88.75 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.122 0.487 . . . . 0.0 110.408 -179.735 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 219' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -72.84 -47.43 46.31 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.496 -0.482 . . . . 0.0 110.696 179.366 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -62.85 -51.11 68.3 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.888 0.375 . . . . 0.0 111.19 -179.847 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 221' ' ' ILE . . . . . 0.525 ' CG2' ' N ' ' B' ' 222' ' ' TYR . 10.9 tp -58.65 -47.13 89.69 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.363 -178.931 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 222' ' ' TYR . . . . . 0.525 ' N ' ' CG2' ' B' ' 221' ' ' ILE . 89.1 t80 -60.24 -39.7 87.64 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.258 179.863 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 223' ' ' HIS . . . . . 0.514 ' CE1' ' OD2' ' A' ' 91' ' ' ASP . 0.9 OUTLIER -60.89 -41.91 96.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.979 179.659 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 6.2 t -73.58 -38.34 65.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.923 0.392 . . . . 0.0 110.889 179.589 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 225' ' ' GLU . . . . . 0.481 ' O ' ' CD2' ' B' ' 228' ' ' HIS . 80.1 tt0 -64.82 -35.14 80.15 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.681 -179.504 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 76.6 t60 -79.2 1.37 24.87 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.649 -179.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 227' ' ' LEU . . . . . . . . . . . . . 36.1 tp -80.43 82.16 6.53 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.466 -179.386 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 228' ' ' HIS . . . . . 0.481 ' CD2' ' O ' ' B' ' 225' ' ' GLU . 95.9 m-70 -138.39 149.52 45.62 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.55 179.754 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 229' ' ' LEU . . . . . 0.499 ' N ' ' CD1' ' B' ' 229' ' ' LEU . 9.5 mp -63.15 -41.93 99.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.262 -179.689 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . 92.25 93.31 1.41 Allowed Glycine 0 CA--C 1.526 0.738 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 -179.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 231' ' ' LEU . . . . . . . . . . . . . 69.1 mt -76.2 148.31 37.8 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.765 0.317 . . . . 0.0 110.539 -179.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 232' ' ' SER . . . . . . . . . . . . . 91.4 p -62.83 154.17 30.78 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.34 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 233' ' ' ASP . . . . . . . . . . . . . 97.1 m-20 -93.01 108.03 19.69 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.263 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 234' ' ' ARG . . . . . . . . . . . . . 89.7 mtm-85 -90.58 143.21 26.96 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.398 179.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 235' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -151.54 70.57 8.16 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.445 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 236' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -53.21 -39.09 81.75 Favored 'Trans proline' 0 C--N 1.307 -1.652 0 C-N-CA 122.84 2.36 . . . . 0.0 112.014 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 237' ' ' SER . . . . . . . . . . . . . 37.6 t 54.23 65.77 1.42 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.399 -179.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 238' ' ' ALA . . . . . . . . . . . . . . . -64.44 -36.71 85.07 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.567 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.746 0 CA-C-O 117.963 -1.465 . . . . 0.0 110.933 179.991 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.25 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 50.13 87.65 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.833 0.349 . . . . 0.0 110.701 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 81.9 -3.1 81.47 Favored Glycine 0 CA--C 1.523 0.538 0 N-CA-C 111.018 -0.833 . . . . 0.0 111.018 179.849 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 92.1 t -127.75 130.85 70.27 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 CA-C-O 120.891 0.376 . . . . 0.0 110.407 179.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 44.58 26.47 0.18 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.568 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -61.0 -40.84 99.06 Favored Glycine 0 CA--C 1.522 0.512 0 N-CA-C 110.926 -0.869 . . . . 0.0 110.926 -179.755 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 61.6 ttt85 -117.43 104.83 11.49 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 179.758 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 59.9 t-20 -96.93 112.69 24.33 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.523 179.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 61.4 mtp180 -89.27 147.78 39.11 Favored Pre-proline 0 CA--C 1.536 0.432 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.504 -179.585 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -44.05 134.6 8.35 Favored 'Trans proline' 0 N--CA 1.492 1.387 0 C-N-CA 122.276 1.984 . . . . 0.0 112.28 179.268 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.457 ' O ' ' O ' ' A' ' 13' ' ' ALA . 48.1 t -152.45 142.66 22.4 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.441 179.923 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.457 ' O ' ' O ' ' A' ' 12' ' ' SER . . . 56.84 150.81 0.06 OUTLIER Pre-proline 0 CA--C 1.542 0.663 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.858 179.926 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.478 ' C ' ' H ' ' A' ' 16' ' ' ASP . 61.5 Cg_endo -73.13 153.15 51.58 Favored 'Trans proline' 0 C--N 1.31 -1.455 0 C-N-CA 122.504 2.136 . . . . 0.0 112.018 179.0 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.413 ' CD1' ' N ' ' A' ' 15' ' ' LEU . 5.7 mp -78.02 32.99 0.18 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.432 179.74 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.478 ' H ' ' C ' ' A' ' 14' ' ' PRO . 97.8 m-20 -96.56 -59.74 1.75 Allowed 'General case' 0 C--O 1.238 0.461 0 CA-C-O 121.321 0.581 . . . . 0.0 111.022 179.012 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 87.8 p -57.66 -33.11 67.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.271 -179.646 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 94.1 mm-40 -67.14 -50.73 60.25 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.282 179.752 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -56.05 -34.83 66.26 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.031 -179.656 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.66 -53.09 24.5 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 121.275 0.56 . . . . 0.0 110.422 179.378 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.96 -46.18 90.25 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.246 179.845 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.477 ' N ' ' OE1' ' A' ' 22' ' ' GLN . 0.9 OUTLIER -60.09 -52.26 66.13 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.037 0.446 . . . . 0.0 110.606 -179.574 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 77.5 t -62.3 -46.91 95.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 C-N-CA 120.457 -0.497 . . . . 0.0 110.06 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -50.47 -47.91 56.87 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-O 120.99 0.424 . . . . 0.0 110.224 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.5 t -59.38 -42.84 92.58 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.342 179.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 95.0 m -61.42 -51.2 69.73 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.766 -179.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.45 ' N ' ' CD1' ' A' ' 27' ' ' LEU . 7.6 mp -67.17 -22.14 65.77 Favored 'General case' 0 CA--C 1.523 -0.075 0 CA-C-O 120.763 0.316 . . . . 0.0 110.645 179.759 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -71.26 -62.48 1.39 Allowed 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.526 179.112 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -57.25 -53.68 55.42 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 120.753 -0.379 . . . . 0.0 110.591 -179.346 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.493 ' O ' ' O ' ' A' ' 31' ' ' ALA . 85.7 mt -46.54 -31.4 2.75 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.417 -178.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.493 ' O ' ' O ' ' A' ' 30' ' ' LEU . . . -57.06 -127.87 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.423 0 O-C-N 123.667 0.604 . . . . 0.0 110.339 179.522 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.43 ' O ' ' O ' ' A' ' 31' ' ' ALA . 0.5 OUTLIER 53.88 108.26 0.02 OUTLIER Pre-proline 0 CA--C 1.544 0.738 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.592 179.973 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -48.48 -56.01 3.54 Favored 'Trans proline' 0 N--CA 1.494 1.535 0 C-N-CA 122.061 1.841 . . . . 0.0 113.282 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 79.9 p -59.88 -46.19 90.1 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.097 -178.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 35.5 ttm180 -62.78 -43.4 98.91 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.426 -179.786 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.412 HD21 HH22 ' A' ' 43' ' ' ARG . 1.9 tt -61.46 -53.37 57.4 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.675 -178.785 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.57 ' CE ' HE21 ' A' ' 41' ' ' GLN . 11.0 tpt -51.55 -48.74 62.97 Favored 'General case' 0 C--O 1.242 0.66 0 C-N-CA 120.338 -0.545 . . . . 0.0 110.419 -179.788 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 96.6 mt -60.8 -46.48 96.07 Favored 'Isoleucine or valine' 0 C--O 1.243 0.72 0 CA-C-O 121.545 0.688 . . . . 0.0 110.375 -179.264 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 72.6 mt -59.98 -41.4 91.92 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.14 179.813 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 13.8 m -55.48 -43.08 75.21 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.119 179.698 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.57 HE21 ' CE ' ' A' ' 37' ' ' MET . 99.2 mm-40 -61.52 -44.21 97.47 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.401 -0.52 . . . . 0.0 110.72 179.676 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.417 ' C ' ' N ' ' A' ' 44' ' ' ASN . 13.7 tp -68.57 -44.3 74.75 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.335 -0.546 . . . . 0.0 111.323 180.0 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.412 HH22 HD21 ' A' ' 36' ' ' LEU . 89.3 mtm-85 -49.18 -17.14 0.2 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.322 -178.879 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.417 ' N ' ' C ' ' A' ' 42' ' ' LEU . 60.9 t-20 -147.06 65.22 1.16 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.086 179.795 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 159.29 82.01 0.04 OUTLIER Glycine 0 CA--C 1.529 0.937 0 N-CA-C 111.121 -0.792 . . . . 0.0 111.121 -179.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_exo -69.77 113.34 3.34 Favored 'Trans proline' 0 N--CA 1.497 1.711 0 C-N-CA 123.172 2.581 . . . . 0.0 111.061 178.786 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -167.15 158.61 10.48 Favored Pre-proline 0 C--N 1.324 -0.531 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.544 -179.171 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -62.71 -171.59 0.11 Allowed 'Trans proline' 0 N--CA 1.497 1.68 0 C-N-CA 122.667 2.245 . . . . 0.0 112.052 178.756 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.548 ' O ' ' N ' ' A' ' 52' ' ' LEU . 46.4 t -75.69 -62.99 1.13 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.353 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.509 -179.918 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.431 ' C ' ' O ' ' A' ' 49' ' ' VAL . 14.5 m -34.7 -49.32 0.41 Allowed 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 121.184 0.516 . . . . 0.0 110.597 -179.268 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -61.79 -44.32 97.12 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.275 178.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.548 ' N ' ' O ' ' A' ' 49' ' ' VAL . 1.3 tt -62.47 -38.67 90.73 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.773 -179.919 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.12 -42.02 93.86 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.047 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -62.66 -43.96 97.48 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.134 179.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.99 -54.95 22.4 Favored 'General case' 0 C--N 1.332 -0.159 0 C-N-CA 120.584 -0.446 . . . . 0.0 110.951 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.438 ' CG2' ' O ' ' A' ' 56' ' ' ILE . 6.8 tt -176.75 86.45 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.456 -0.133 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.761 -179.863 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . 0.508 ' O ' ' N ' ' A' ' 59' ' ' GLU . . . -157.6 -49.79 0.01 OUTLIER Glycine 0 CA--C 1.523 0.544 0 N-CA-C 110.425 -1.07 . . . . 0.0 110.425 178.608 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 99.6 mtp 43.0 17.86 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.747 0.308 . . . . 0.0 110.745 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.508 ' N ' ' O ' ' A' ' 57' ' ' GLY . 95.8 mt-10 -148.31 68.61 1.09 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.152 0.501 . . . . 0.0 109.725 -179.374 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 8.7 mt-30 -58.46 -36.32 73.52 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.798 -179.397 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 37.7 t -62.15 -45.35 93.81 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.777 -179.749 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -61.89 -36.22 80.64 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.293 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 94.0 t -65.41 -50.7 71.21 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 C-N-CA 120.657 -0.417 . . . . 0.0 110.587 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.4 t -57.74 -45.98 85.1 Favored 'General case' 0 C--N 1.332 -0.165 0 C-N-CA 120.722 -0.391 . . . . 0.0 110.331 -179.275 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 48.8 m170 -61.65 -48.0 82.81 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-O 121.191 0.52 . . . . 0.0 110.618 179.803 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 44.5 tt0 -61.83 -40.11 94.14 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.217 -179.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.6 tp -62.39 -43.27 99.21 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.232 -179.472 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -60.7 -42.92 98.13 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 120.827 -0.349 . . . . 0.0 110.732 -179.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 95.8 t -64.88 -54.19 32.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 C-N-CA 119.898 -0.721 . . . . 0.0 110.674 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 96.6 mt -59.48 -40.34 86.67 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 -178.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 62.2 ttp180 -57.97 -41.42 82.91 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.218 179.703 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -58.04 -48.62 79.54 Favored 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 120.596 -0.441 . . . . 0.0 110.539 -179.585 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.492 ' CD2' ' N ' ' A' ' 73' ' ' LEU . 4.0 mm? -66.36 -41.08 89.98 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.63 179.544 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 107.42 38.83 2.03 Favored Glycine 0 CA--C 1.525 0.671 0 N-CA-C 111.089 -0.805 . . . . 0.0 111.089 -179.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.422 ' N ' ' CD1' ' A' ' 75' ' ' LEU . 9.9 mp -98.86 -13.22 20.16 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 110.446 -0.205 . . . . 0.0 110.446 179.43 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 23.1 m -136.33 155.53 34.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 24.8 t -139.84 150.23 22.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.663 179.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -110.67 158.11 14.59 Favored Glycine 0 CA--C 1.523 0.552 0 N-CA-C 110.153 -1.179 . . . . 0.0 110.153 178.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -131.47 146.86 52.44 Favored 'General case' 0 CA--C 1.515 -0.378 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 -179.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 62.3 ttp180 -111.5 137.97 48.63 Favored 'General case' 0 N--CA 1.468 0.428 0 O-C-N 123.513 0.508 . . . . 0.0 110.411 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -147.85 128.78 14.44 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.409 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 48.13 -99.1 0.02 OUTLIER Glycine 0 CA--C 1.523 0.534 0 N-CA-C 110.776 -0.93 . . . . 0.0 110.776 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 66.5 ttt-85 -132.29 45.43 2.76 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.066 0.46 . . . . 0.0 110.145 -179.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 88.8 p -163.53 164.12 24.4 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 121.009 0.433 . . . . 0.0 109.938 -179.855 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.404 ' C ' ' CD1' ' A' ' 85' ' ' ILE . 1.0 OUTLIER -140.01 156.93 25.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.549 179.603 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 15.5 m -133.92 156.64 41.33 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.394 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.324 179.2 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 77.5 m-85 -108.03 136.56 47.52 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.279 -179.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.642 ' HG ' ' N ' ' A' ' 89' ' ' LEU . 47.5 t -150.63 170.03 20.16 Favored 'General case' 0 CA--C 1.514 -0.439 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 -179.948 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.642 ' N ' ' HG ' ' A' ' 88' ' ' SER . 4.4 mm? -61.66 153.26 28.57 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.737 179.259 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 65.5 t80 -50.51 -45.83 56.83 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.485 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.498 ' OD2' ' CG ' ' A' ' 93' ' ' HIS . 28.3 t70 -156.88 168.41 27.55 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.937 -0.305 . . . . 0.0 110.507 179.88 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 64.1 p -68.88 -32.28 71.82 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.838 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . 0.498 ' CG ' ' OD2' ' A' ' 91' ' ' ASP . 27.3 m170 -39.46 -67.79 0.2 Allowed 'General case' 0 C--O 1.24 0.56 0 CA-C-O 121.34 0.591 . . . . 0.0 110.716 -179.9 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 57.7 t -45.73 -40.42 3.22 Favored 'Isoleucine or valine' 0 C--O 1.236 0.395 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.32 179.744 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.49 -38.09 86.04 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.31 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -60.74 -44.99 95.98 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.303 0.573 . . . . 0.0 110.028 -179.653 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.518 ' N ' ' CD1' ' A' ' 97' ' ' LEU . 6.4 mp -61.51 -46.32 90.48 Favored 'General case' 0 C--O 1.24 0.592 0 CA-C-O 121.522 0.677 . . . . 0.0 110.193 -179.467 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 17.7 mt -66.61 -33.86 76.59 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.259 179.494 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 91.7 m-20 -59.87 -42.48 93.78 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 -179.597 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -65.45 -48.68 71.85 Favored 'General case' 0 N--CA 1.462 0.149 0 N-CA-C 109.819 -0.438 . . . . 0.0 109.819 179.458 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.26 -44.82 96.63 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.946 179.439 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 5.3 mm -63.63 -46.17 95.56 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.932 -179.824 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 90.2 t80 -63.78 -50.78 67.65 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 120.711 -0.396 . . . . 0.0 110.643 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 56.7 t-80 -59.93 -33.9 72.51 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.677 -179.617 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 7.5 t -76.06 -50.37 14.93 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.866 0.365 . . . . 0.0 111.323 179.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -64.81 -22.03 66.9 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.534 -179.733 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 34.5 t60 -60.22 -73.31 0.09 Allowed 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 120.551 -0.46 . . . . 0.0 110.524 -179.048 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 45.1 mt -79.87 -45.25 18.98 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.018 0.437 . . . . 0.0 110.447 179.779 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 51.2 t-80 43.93 51.62 6.89 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.757 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 70.6 mt -63.33 -42.41 98.96 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.702 -179.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 88.32 -106.32 3.23 Favored Glycine 0 CA--C 1.524 0.628 0 N-CA-C 111.041 -0.824 . . . . 0.0 111.041 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.443 ' CD1' ' N ' ' A' ' 112' ' ' LEU . 10.0 mp 43.94 60.22 2.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.851 0.358 . . . . 0.0 110.514 -179.754 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 69.0 m -60.79 -41.29 95.32 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.346 179.841 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 52.11 28.05 5.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.455 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 -142.92 11.93 1.83 Allowed 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.711 -179.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . 0.625 ' N ' ' CD ' ' A' ' 117' ' ' PRO . 0.8 OUTLIER -64.84 -42.38 62.73 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.355 179.787 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . 0.625 ' CD ' ' N ' ' A' ' 116' ' ' HIS . 36.9 Cg_exo -59.9 143.01 99.65 Favored 'Trans proline' 0 C--N 1.309 -1.544 0 C-N-CA 122.499 2.133 . . . . 0.0 111.86 -179.241 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 41.6 m -61.09 -41.54 96.86 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.508 179.635 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . 48.28 94.54 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.543 -179.82 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.772 0 CA-C-O 118.006 -1.441 . . . . 0.0 110.982 -179.914 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.29 0 N-CA-C 109.489 -1.444 . . . . 0.0 109.489 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 47.57 86.55 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.883 0.373 . . . . 0.0 110.713 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 123' ' ' GLY . . . . . . . . . . . . . . . 82.32 -5.68 71.62 Favored Glycine 0 CA--C 1.522 0.471 0 N-CA-C 111.0 -0.84 . . . . 0.0 111.0 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 76.5 t -125.3 130.33 72.95 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.375 0 CA-C-O 120.792 0.33 . . . . 0.0 110.215 179.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 125' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 45.24 26.87 0.29 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.491 179.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -62.01 -41.22 99.66 Favored Glycine 0 CA--C 1.523 0.562 0 N-CA-C 110.987 -0.845 . . . . 0.0 110.987 -179.813 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 127' ' ' ARG . . . . . . . . . . . . . 61.6 ttt85 -117.1 106.64 13.58 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.855 0.36 . . . . 0.0 110.058 179.762 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 128' ' ' ASN . . . . . . . . . . . . . 61.3 t-20 -100.01 114.65 28.1 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.465 -179.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 129' ' ' ARG . . . . . . . . . . . . . 60.6 mtp180 -92.07 147.22 34.31 Favored Pre-proline 0 CA--C 1.536 0.416 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.252 -179.561 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -44.42 135.99 8.8 Favored 'Trans proline' 0 N--CA 1.491 1.35 0 C-N-CA 122.346 2.031 . . . . 0.0 112.532 179.491 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 131' ' ' SER . . . . . 0.449 ' O ' ' O ' ' B' ' 132' ' ' ALA . 46.7 t -155.62 142.3 18.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.406 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 132' ' ' ALA . . . . . 0.449 ' O ' ' O ' ' B' ' 131' ' ' SER . . . 56.69 150.16 0.06 OUTLIER Pre-proline 0 CA--C 1.543 0.706 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.124 179.936 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 133' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -73.46 149.1 43.94 Favored 'Trans proline' 0 C--N 1.311 -1.422 0 C-N-CA 122.418 2.079 . . . . 0.0 112.101 179.001 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . 0.522 ' O ' ' N ' ' B' ' 137' ' ' GLN . 6.5 mp -63.69 -39.02 93.29 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.478 179.675 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 135' ' ' ASP . . . . . 0.422 ' C ' ' O ' ' B' ' 134' ' ' LEU . 97.9 m-20 -32.49 -55.38 0.34 Allowed 'General case' 0 N--CA 1.469 0.477 0 O-C-N 123.621 0.576 . . . . 0.0 111.056 -178.715 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 77.5 p -56.77 -45.66 81.96 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.176 179.237 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 137' ' ' GLN . . . . . 0.522 ' N ' ' O ' ' B' ' 134' ' ' LEU . 95.5 mm-40 -62.56 -45.73 91.57 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.306 -179.965 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 138' ' ' ALA . . . . . . . . . . . . . . . -56.64 -34.29 67.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.277 -179.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.7 -53.26 23.22 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-O 121.045 0.45 . . . . 0.0 110.419 179.394 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -60.17 -46.65 88.96 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 120.604 -0.438 . . . . 0.0 111.356 179.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 141' ' ' GLN . . . . . 0.511 ' N ' ' OE1' ' B' ' 141' ' ' GLN . 0.8 OUTLIER -59.29 -52.57 65.07 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.114 0.483 . . . . 0.0 110.767 -179.439 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 142' ' ' VAL . . . . . . . . . . . . . 96.7 t -62.05 -47.09 94.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 C-N-CA 120.395 -0.522 . . . . 0.0 110.113 -179.8 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -50.85 -47.26 60.32 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 120.931 0.396 . . . . 0.0 110.322 -179.649 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 14.4 t -59.28 -42.33 90.99 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.019 179.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 96.4 m -62.57 -51.61 66.66 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.406 -0.518 . . . . 0.0 110.806 -179.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 146' ' ' LEU . . . . . 0.423 ' N ' ' CD1' ' B' ' 146' ' ' LEU . 7.8 mp -66.24 -22.62 66.33 Favored 'General case' 0 CA--C 1.523 -0.096 0 CA-C-O 120.807 0.337 . . . . 0.0 110.653 179.602 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 147' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -70.89 -63.28 1.13 Allowed 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.593 179.262 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -56.85 -53.28 59.71 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 120.691 -0.404 . . . . 0.0 110.924 -179.297 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.494 ' O ' ' O ' ' B' ' 150' ' ' ALA . 88.9 mt -46.5 -31.0 2.47 Favored 'General case' 0 CA--C 1.511 -0.548 0 C-N-CA 120.956 -0.298 . . . . 0.0 110.503 -179.106 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 150' ' ' ALA . . . . . 0.494 ' O ' ' O ' ' B' ' 149' ' ' LEU . . . -57.57 -128.58 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.454 0 O-C-N 123.54 0.525 . . . . 0.0 110.517 179.511 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 151' ' ' THR . . . . . 0.436 ' O ' ' O ' ' B' ' 150' ' ' ALA . 0.6 OUTLIER 53.81 107.39 0.02 OUTLIER Pre-proline 0 CA--C 1.543 0.677 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.554 179.946 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -47.9 -59.25 1.32 Allowed 'Trans proline' 0 N--CA 1.494 1.533 0 C-N-CA 122.122 1.881 . . . . 0.0 113.338 -179.811 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 78.2 p -56.6 -46.6 80.78 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.055 -178.76 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 36.1 ttm180 -62.4 -43.33 99.07 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.451 179.795 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 155' ' ' LEU . . . . . . . . . . . . . 1.8 tt -61.05 -53.88 51.75 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 120.468 -0.493 . . . . 0.0 110.582 -178.733 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 156' ' ' MET . . . . . 0.552 ' CE ' HE21 ' B' ' 160' ' ' GLN . 11.0 tpt -51.16 -48.86 61.78 Favored 'General case' 0 C--O 1.24 0.584 0 C-N-CA 120.178 -0.609 . . . . 0.0 110.425 -179.741 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 157' ' ' ILE . . . . . 0.414 HG21 HD11 ' B' ' 157' ' ' ILE . 96.3 mt -59.94 -47.33 92.07 Favored 'Isoleucine or valine' 0 C--O 1.244 0.785 0 CA-C-O 121.715 0.769 . . . . 0.0 110.29 -179.417 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 75.3 mt -59.11 -41.89 89.24 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.053 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 13.6 m -54.77 -43.53 72.88 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.354 179.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 160' ' ' GLN . . . . . 0.552 HE21 ' CE ' ' B' ' 156' ' ' MET . 98.9 mm-40 -60.72 -44.68 96.32 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.393 -0.523 . . . . 0.0 110.574 179.725 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 161' ' ' LEU . . . . . . . . . . . . . 13.4 tp -68.43 -43.73 76.47 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.351 -0.54 . . . . 0.0 111.401 179.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 162' ' ' ARG . . . . . . . . . . . . . 88.5 mtm-85 -50.04 -19.63 0.77 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.355 -178.8 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 55.3 t-20 -142.89 64.81 1.35 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.057 179.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . 156.81 88.72 0.07 OUTLIER Glycine 0 CA--C 1.539 1.579 0 N-CA-C 110.978 -0.849 . . . . 0.0 110.978 179.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -77.87 113.98 3.55 Favored 'Trans proline' 0 N--CA 1.496 1.639 0 C-N-CA 122.518 2.145 . . . . 0.0 110.966 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -164.98 158.29 14.29 Favored Pre-proline 0 C--N 1.325 -0.462 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.711 -178.663 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_endo -61.08 -172.02 0.08 OUTLIER 'Trans proline' 0 N--CA 1.496 1.621 0 C-N-CA 122.871 2.381 . . . . 0.0 112.1 178.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 168' ' ' VAL . . . . . 0.554 ' O ' ' N ' ' B' ' 171' ' ' LEU . 47.1 t -75.39 -62.85 1.18 Allowed 'Isoleucine or valine' 0 C--O 1.224 -0.282 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.504 -179.786 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 169' ' ' THR . . . . . 0.423 ' C ' ' O ' ' B' ' 168' ' ' VAL . 17.3 m -34.58 -48.72 0.38 Allowed 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 121.126 0.488 . . . . 0.0 110.624 -179.157 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -62.44 -44.14 97.14 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.285 178.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 171' ' ' LEU . . . . . 0.554 ' N ' ' O ' ' B' ' 168' ' ' VAL . 1.2 tt -62.37 -39.32 92.79 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.226 0.536 . . . . 0.0 109.812 -179.819 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 172' ' ' ALA . . . . . . . . . . . . . . . -60.7 -42.29 96.91 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.328 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -62.25 -43.02 99.78 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.112 179.777 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -66.76 -54.54 21.78 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.587 -0.445 . . . . 0.0 110.931 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 175' ' ' ILE . . . . . 0.434 ' CG2' ' O ' ' B' ' 175' ' ' ILE . 8.8 tt -176.97 86.97 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.456 -0.147 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.719 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 176' ' ' GLY . . . . . 0.533 ' O ' ' N ' ' B' ' 178' ' ' GLU . . . -157.56 -49.0 0.01 OUTLIER Glycine 0 CA--C 1.522 0.471 0 N-CA-C 110.528 -1.029 . . . . 0.0 110.528 178.611 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 97.6 mtp 41.81 19.42 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.139 0 CA-C-O 120.787 0.327 . . . . 0.0 110.755 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 178' ' ' GLU . . . . . 0.533 ' N ' ' O ' ' B' ' 176' ' ' GLY . 94.3 mt-10 -150.06 67.05 0.97 Allowed 'General case' 0 CA--C 1.52 -0.195 0 CA-C-O 121.049 0.452 . . . . 0.0 109.989 -179.342 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 9.1 mt-30 -57.09 -37.28 71.67 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.863 -179.64 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 44.5 t -61.97 -45.95 91.42 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.805 -179.76 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -61.62 -36.4 80.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.404 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 95.5 t -64.91 -50.71 73.79 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 C-N-CA 120.593 -0.443 . . . . 0.0 110.656 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 12.0 t -58.31 -45.23 88.43 Favored 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.086 -178.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 46.6 m170 -61.67 -47.67 84.29 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-O 121.209 0.528 . . . . 0.0 110.656 179.591 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 43.2 tt0 -62.1 -40.21 95.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.234 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 6.9 tp -62.63 -43.2 99.4 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.404 -179.658 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -60.2 -42.8 95.86 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.754 -0.379 . . . . 0.0 110.315 179.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 73.9 t -64.69 -54.39 30.75 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.211 0 C-N-CA 119.898 -0.721 . . . . 0.0 110.558 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 98.5 mt -59.67 -40.95 89.49 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 -178.704 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 62.1 ttp180 -56.95 -42.25 79.74 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.29 179.775 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 40.6 t30 -57.03 -50.79 71.66 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.586 -0.446 . . . . 0.0 110.487 -179.671 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 192' ' ' LEU . . . . . 0.497 ' CD2' ' N ' ' B' ' 192' ' ' LEU . 3.9 mm? -64.45 -41.69 96.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.646 179.819 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 107.89 38.01 2.09 Favored Glycine 0 CA--C 1.524 0.613 0 N-CA-C 111.13 -0.788 . . . . 0.0 111.13 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 194' ' ' LEU . . . . . 0.446 ' N ' ' CD1' ' B' ' 194' ' ' LEU . 9.8 mp -97.49 -12.97 22.01 Favored 'General case' 0 N--CA 1.466 0.371 0 O-C-N 122.766 -0.255 . . . . 0.0 110.394 179.355 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 26.2 m -137.21 156.23 33.43 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.384 0 N-CA-C 109.981 -0.378 . . . . 0.0 109.981 -179.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 196' ' ' VAL . . . . . . . . . . . . . 29.9 t -141.42 152.55 19.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.451 179.583 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 197' ' ' GLY . . . . . . . . . . . . . . . -112.1 160.65 13.06 Favored Glycine 0 CA--C 1.522 0.509 0 N-CA-C 110.379 -1.088 . . . . 0.0 110.379 179.365 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 95.3 m-20 -132.13 145.55 51.46 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 62.2 ttp180 -110.16 133.84 52.81 Favored 'General case' 0 N--CA 1.466 0.367 0 O-C-N 123.4 0.438 . . . . 0.0 110.431 179.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 200' ' ' ALA . . . . . . . . . . . . . . . -145.45 132.53 20.36 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.389 179.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 201' ' ' GLY . . . . . . . . . . . . . . . 47.15 -104.45 0.08 OUTLIER Glycine 0 CA--C 1.522 0.528 0 N-CA-C 110.511 -1.036 . . . . 0.0 110.511 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 202' ' ' ARG . . . . . . . . . . . . . 68.2 ttt-85 -128.61 47.17 2.48 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 121.093 0.473 . . . . 0.0 109.967 179.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 85.8 p -164.92 166.87 19.15 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 121.036 0.445 . . . . 0.0 109.982 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 204' ' ' ILE . . . . . 0.415 ' CD1' ' C ' ' B' ' 204' ' ' ILE . 1.0 OUTLIER -141.34 158.21 22.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.546 179.53 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 12.3 m -134.54 157.17 41.17 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.327 179.119 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 79.7 m-85 -108.53 137.22 46.84 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.303 -179.813 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 207' ' ' SER . . . . . 0.701 ' HG ' ' H ' ' B' ' 208' ' ' LEU . 40.1 t -150.75 169.93 20.45 Favored 'General case' 0 C--O 1.222 -0.391 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 208' ' ' LEU . . . . . 0.701 ' H ' ' HG ' ' B' ' 207' ' ' SER . 4.4 mm? -62.27 153.69 29.96 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.718 179.23 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -50.51 -46.77 57.37 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.479 179.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 210' ' ' ASP . . . . . 0.523 ' OD2' ' CG ' ' B' ' 212' ' ' HIS . 31.5 t70 -156.42 166.14 34.3 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.911 0.386 . . . . 0.0 110.485 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 74.1 p -67.27 -32.09 72.87 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.622 -179.773 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 212' ' ' HIS . . . . . 0.523 ' CG ' ' OD2' ' B' ' 210' ' ' ASP . 29.9 m170 -39.46 -67.49 0.22 Allowed 'General case' 0 C--O 1.238 0.457 0 CA-C-O 121.308 0.575 . . . . 0.0 110.779 -179.936 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 59.3 t -45.99 -39.24 3.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.336 179.561 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 214' ' ' ALA . . . . . . . . . . . . . . . -62.49 -38.18 88.87 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.339 179.83 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 57.5 tt0 -60.44 -44.89 95.36 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.247 0.546 . . . . 0.0 109.994 -179.743 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 216' ' ' LEU . . . . . 0.524 ' CD1' ' N ' ' B' ' 216' ' ' LEU . 6.3 mp -61.99 -45.73 92.35 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-O 121.431 0.634 . . . . 0.0 110.39 -179.567 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 67.1 mt -66.55 -34.97 79.09 Favored 'General case' 0 C--O 1.218 -0.571 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.118 179.444 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -60.07 -42.67 95.06 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 -179.735 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 219' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -64.6 -47.79 77.3 Favored 'General case' 0 CA--C 1.52 -0.187 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 179.429 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -62.94 -44.42 96.11 Favored 'General case' 0 CA--C 1.518 -0.262 0 C-N-CA 120.643 -0.423 . . . . 0.0 111.098 179.28 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 5.2 mm -63.93 -45.68 96.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 C-N-CA 120.729 -0.388 . . . . 0.0 110.98 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 89.7 t80 -63.65 -50.35 69.65 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.564 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 223' ' ' HIS . . . . . . . . . . . . . 52.0 t-80 -60.58 -33.34 72.58 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.691 -179.721 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 10.6 t -76.4 -50.79 13.26 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.918 0.39 . . . . 0.0 111.501 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -64.34 -24.16 67.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.705 -179.793 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 32.9 t60 -58.15 -72.39 0.09 Allowed 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.552 -0.459 . . . . 0.0 110.476 -179.18 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 227' ' ' LEU . . . . . . . . . . . . . 46.9 mt -80.44 -47.22 14.68 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.98 0.419 . . . . 0.0 110.48 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 228' ' ' HIS . . . . . 0.416 ' ND1' ' O ' ' B' ' 228' ' ' HIS . 53.2 t-80 44.94 51.52 8.62 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.792 -179.904 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 229' ' ' LEU . . . . . . . . . . . . . 66.6 mt -62.95 -41.68 99.58 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.61 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . 88.27 -105.17 3.11 Favored Glycine 0 CA--C 1.525 0.666 0 N-CA-C 110.911 -0.876 . . . . 0.0 110.911 -179.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 231' ' ' LEU . . . . . 0.44 ' N ' ' CD1' ' B' ' 231' ' ' LEU . 9.9 mp 42.49 61.07 2.15 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.873 0.368 . . . . 0.0 110.585 -179.881 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 232' ' ' SER . . . . . . . . . . . . . 49.9 m -62.37 -43.15 99.5 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.57 179.83 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 233' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 54.14 28.2 8.67 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.518 -179.844 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 234' ' ' ARG . . . . . . . . . . . . . 89.4 mtm180 -143.02 13.38 1.85 Allowed 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.756 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 235' ' ' HIS . . . . . 0.62 ' N ' ' CD ' ' B' ' 236' ' ' PRO . 0.9 OUTLIER -66.45 -41.81 43.34 Favored Pre-proline 0 C--N 1.327 -0.396 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.496 179.657 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 236' ' ' PRO . . . . . 0.62 ' CD ' ' N ' ' B' ' 235' ' ' HIS . 35.5 Cg_exo -60.02 144.12 99.5 Favored 'Trans proline' 0 C--N 1.309 -1.507 0 C-N-CA 122.599 2.199 . . . . 0.0 112.013 -179.172 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 237' ' ' SER . . . . . 0.404 ' O ' ' O ' ' B' ' 238' ' ' ALA . 19.5 m -61.31 -40.6 94.79 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.306 179.53 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 238' ' ' ALA . . . . . 0.404 ' O ' ' O ' ' B' ' 237' ' ' SER . . . 46.82 96.09 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.527 -179.86 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.723 0 CA-C-O 117.953 -1.471 . . . . 0.0 110.911 -179.976 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.26 0 N-CA-C 109.529 -1.429 . . . . 0.0 109.529 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 98.8 m-70 41.68 -118.38 0.41 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.725 0.298 . . . . 0.0 110.618 -179.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 66.44 32.29 81.36 Favored Glycine 0 CA--C 1.524 0.631 0 N-CA-C 110.911 -0.876 . . . . 0.0 110.911 179.813 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 34.7 m -72.58 131.63 34.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.924 0.392 . . . . 0.0 110.486 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 16.3 mm-40 -89.85 -172.83 3.68 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.448 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . 0.54 ' O ' ' N ' ' A' ' 9' ' ' ASN . . . -162.56 -117.24 0.41 Allowed Glycine 0 CA--C 1.522 0.485 0 N-CA-C 110.887 -0.885 . . . . 0.0 110.887 -179.876 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.401 ' O ' ' O ' ' A' ' 9' ' ' ASN . 77.1 ttt180 40.84 -90.3 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.628 0.252 . . . . 0.0 110.764 -179.701 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.54 ' N ' ' O ' ' A' ' 7' ' ' GLY . 13.7 m120 45.71 -171.29 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.542 179.829 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 66.2 mtt85 56.58 75.87 0.54 Allowed Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.539 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_exo -60.31 143.95 99.5 Favored 'Trans proline' 0 C--N 1.306 -1.687 0 C-N-CA 122.881 2.387 . . . . 0.0 112.013 179.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.432 ' OG ' ' O ' ' A' ' 12' ' ' SER . 48.3 p 42.59 73.87 0.13 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.718 179.767 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.629 ' N ' ' CD ' ' A' ' 14' ' ' PRO . . . -100.62 -41.06 0.22 Allowed Pre-proline 0 N--CA 1.466 0.357 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.653 179.83 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.629 ' CD ' ' N ' ' A' ' 13' ' ' ALA . 24.5 Cg_exo -62.32 32.44 0.07 OUTLIER 'Trans proline' 0 C--N 1.309 -1.521 0 C-N-CA 122.952 2.435 . . . . 0.0 112.122 -179.806 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.567 ' H ' ' C ' ' A' ' 13' ' ' ALA . 63.1 mt -64.87 136.2 56.59 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 110.052 -0.351 . . . . 0.0 110.052 -179.846 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.431 ' O ' ' OD1' ' A' ' 16' ' ' ASP . 66.8 t0 -34.0 -33.05 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.273 0 O-C-N 123.533 0.521 . . . . 0.0 110.769 -179.669 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.49 ' N ' ' O ' ' A' ' 15' ' ' LEU . 83.8 p -45.25 -50.78 11.49 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.147 179.246 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -63.44 -42.18 98.66 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.078 179.739 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -57.49 -35.57 70.38 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.25 179.714 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.64 -53.47 33.69 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 110.181 -0.303 . . . . 0.0 110.181 179.573 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.46 -40.42 94.44 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.682 -179.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -61.33 -52.42 64.74 Favored 'General case' 0 C--O 1.242 0.704 0 CA-C-O 121.265 0.555 . . . . 0.0 110.48 -179.883 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 83.5 t -62.18 -46.19 97.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.052 179.616 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -52.93 -43.63 66.41 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 120.87 -0.332 . . . . 0.0 110.207 179.748 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.9 t -59.16 -43.23 92.08 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.234 -0.439 . . . . 0.0 109.927 179.879 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 97.2 m -62.43 -51.47 67.41 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 120.539 -0.464 . . . . 0.0 110.532 179.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.46 ' N ' ' CD1' ' A' ' 27' ' ' LEU . 7.5 mp -65.51 -20.46 66.35 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 116.563 -0.289 . . . . 0.0 110.68 179.61 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 58.8 tt0 -74.04 -60.99 2.01 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.504 179.577 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.68 -54.43 46.53 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.802 -179.385 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.47 ' O ' ' O ' ' A' ' 31' ' ' ALA . 4.0 mm? -47.73 -30.44 3.87 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.187 -179.205 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.47 ' O ' ' O ' ' A' ' 30' ' ' LEU . . . -58.9 -141.4 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.231 0.539 . . . . 0.0 110.453 179.661 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.407 ' O ' ' O ' ' A' ' 31' ' ' ALA . 3.3 m 59.48 115.76 0.02 OUTLIER Pre-proline 0 CA--C 1.541 0.609 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.149 -179.882 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -47.86 -53.15 7.02 Favored 'Trans proline' 0 C--N 1.31 -1.486 0 C-N-CA 122.306 2.004 . . . . 0.0 113.34 -179.068 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 78.0 p -53.01 -48.17 67.75 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.085 -178.576 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 82.8 mtp180 -67.77 -37.88 82.68 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 120.812 -0.355 . . . . 0.0 110.497 -179.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.74 -52.76 63.73 Favored 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 120.25 -0.58 . . . . 0.0 110.86 -178.289 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 5.3 ttt -62.06 -48.12 81.67 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.755 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 94.7 mt -60.63 -45.65 97.04 Favored 'Isoleucine or valine' 0 C--O 1.243 0.741 0 CA-C-O 121.328 0.585 . . . . 0.0 110.481 -179.491 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 43.9 mt -60.68 -40.63 92.85 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.319 179.524 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 19.3 m -59.32 -43.17 92.71 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.024 179.062 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 67.0 tp60 -54.97 -47.03 75.1 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-O 120.984 0.421 . . . . 0.0 109.94 179.863 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 27.9 mt -65.89 -38.47 88.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.928 179.249 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 53.8 ttp180 -54.75 -44.08 73.3 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.09 -178.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -134.27 62.09 1.66 Allowed 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.844 0.354 . . . . 0.0 110.21 179.651 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 177.18 80.24 0.05 OUTLIER Glycine 0 CA--C 1.533 1.202 0 N-CA-C 110.686 -0.966 . . . . 0.0 110.686 -179.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -77.56 104.91 1.95 Allowed 'Trans proline' 0 N--CA 1.494 1.536 0 C-N-CA 122.491 2.128 . . . . 0.0 111.861 -179.365 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -155.88 156.43 30.54 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.342 -179.414 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -65.45 175.51 4.14 Favored 'Trans proline' 0 C--N 1.308 -1.595 0 C-N-CA 122.83 2.353 . . . . 0.0 111.975 179.633 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.482 ' CG2' ' N ' ' A' ' 50' ' ' THR . 5.1 m -63.91 -43.85 97.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.383 0.611 . . . . 0.0 110.994 -179.743 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.482 ' N ' ' CG2' ' A' ' 49' ' ' VAL . 0.2 OUTLIER -58.08 -65.78 0.59 Allowed 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.359 -179.718 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.448 ' H ' HG22 ' A' ' 50' ' ' THR . 41.2 t0 -50.68 -36.49 36.14 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 -179.61 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 9.5 tt -63.12 -41.51 99.34 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.31 179.317 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.26 -42.76 99.62 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-O 120.896 0.379 . . . . 0.0 110.241 -179.573 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -62.41 -41.72 98.9 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.113 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -66.68 -52.94 39.05 Favored 'General case' 0 CA--C 1.521 -0.157 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.847 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.466 ' CG2' ' O ' ' A' ' 56' ' ' ILE . 7.7 tt -175.07 84.1 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.881 -179.871 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -167.01 -59.29 0.03 OUTLIER Glycine 0 CA--C 1.525 0.688 0 N-CA-C 110.523 -1.031 . . . . 0.0 110.523 178.684 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 70.7 mtm 54.0 29.93 10.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.867 0.365 . . . . 0.0 110.451 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.522 ' O ' ' N ' ' A' ' 61' ' ' SER . 19.9 pt-20 -163.99 39.54 0.09 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.593 -179.879 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -40.54 -22.99 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.588 179.692 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.531 ' O ' ' ND1' ' A' ' 65' ' ' HIS . 78.0 p -67.84 -42.55 81.22 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.387 179.883 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.469 ' N ' ' O ' ' A' ' 59' ' ' GLU . . . -66.23 -35.15 79.68 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.313 179.539 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 92.1 t -66.99 -47.94 80.85 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.645 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 75.4 m -60.23 -43.14 96.29 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 120.926 -0.31 . . . . 0.0 110.473 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . 0.531 ' ND1' ' O ' ' A' ' 61' ' ' SER . 35.3 m80 -63.72 -49.94 71.09 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.608 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 93.9 mt-30 -63.71 -37.65 88.15 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.315 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 5.0 tt -62.28 -44.96 95.33 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.549 179.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 19.4 mmm180 -61.92 -41.93 98.5 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.839 0.352 . . . . 0.0 110.39 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 88.9 t -62.7 -55.13 25.67 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.133 0 C-N-CA 119.993 -0.683 . . . . 0.0 110.066 -179.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 81.2 mt -60.86 -35.47 76.68 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.29 -0.414 . . . . 0.0 109.948 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -57.83 -42.03 83.5 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.361 179.843 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -59.68 -45.9 90.7 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.497 -0.481 . . . . 0.0 110.383 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.507 ' CD2' ' N ' ' A' ' 73' ' ' LEU . 3.9 mm? -67.87 -41.8 82.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.762 179.505 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 109.76 91.77 2.15 Favored Glycine 0 CA--C 1.522 0.531 0 N-CA-C 110.953 -0.859 . . . . 0.0 110.953 -179.66 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 55.2 tp -156.84 -25.81 0.09 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.755 0.312 . . . . 0.0 110.577 179.401 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 19.2 m -136.98 158.82 36.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.46 179.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.411 ' CG1' ' N ' ' A' ' 78' ' ' GLY . 71.5 t -143.85 157.33 16.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.393 -179.761 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . 0.411 ' N ' ' CG1' ' A' ' 77' ' ' VAL . . . -124.22 143.4 14.77 Favored Glycine 0 N--CA 1.462 0.382 0 N-CA-C 110.385 -1.086 . . . . 0.0 110.385 179.169 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 -118.0 138.33 52.26 Favored 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 110.024 -0.361 . . . . 0.0 110.024 -179.557 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 52.6 ptt85 -109.12 145.67 35.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.636 179.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -150.33 144.02 25.25 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.385 179.576 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -40.95 -39.08 1.86 Allowed Glycine 0 CA--C 1.524 0.633 0 N-CA-C 110.875 -0.89 . . . . 0.0 110.875 -179.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.455 ' O ' ' OG ' ' A' ' 84' ' ' SER . 82.7 mtp180 -72.56 -44.39 62.16 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.924 -0.311 . . . . 0.0 110.984 179.589 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' SER . . . . . 0.455 ' OG ' ' O ' ' A' ' 83' ' ' ARG . 3.7 m 177.74 -179.04 0.24 Allowed 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 121.064 0.459 . . . . 0.0 109.793 -178.991 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.444 ' C ' ' CD1' ' A' ' 85' ' ' ILE . 0.8 OUTLIER -116.75 153.28 18.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.905 179.636 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 60.2 t -133.44 138.04 51.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.791 179.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 43.0 m-85 -100.38 132.9 45.5 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.298 178.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 48.2 t -150.73 170.97 17.93 Favored 'General case' 0 C--N 1.338 0.095 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.063 -179.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 47.2 mt -71.03 149.85 46.18 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.457 -179.718 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.421 ' O ' ' OD1' ' A' ' 91' ' ' ASP . 1.5 t80 -52.68 -51.34 60.65 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.485 -179.471 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.421 ' OD1' ' O ' ' A' ' 90' ' ' TYR . 98.9 m-20 -139.34 -171.15 3.06 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.412 -179.527 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 66.0 p -96.62 9.14 42.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.458 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 18.1 t-160 -52.39 -67.59 0.24 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.468 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 28.6 m -63.29 -34.35 66.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.34 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -56.46 -51.2 69.33 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.621 -179.839 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 -65.11 -42.92 93.54 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.26 179.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 14.4 tp -60.16 -46.64 89.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.169 0.509 . . . . 0.0 110.275 -179.66 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 71.2 mt -63.86 -37.98 89.4 Favored 'General case' 0 C--O 1.221 -0.415 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.251 179.515 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 66.1 t0 -59.47 -44.46 93.01 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.315 -179.705 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.445 ' O ' ' CG ' ' A' ' 104' ' ' HIS . 15.5 mm-40 -64.71 -50.22 67.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.7 -179.988 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -63.81 -40.45 96.66 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.415 -179.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 4.3 mm -63.75 -48.22 87.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.751 -179.037 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -67.11 -43.57 82.14 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.364 -179.71 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . 0.445 ' CG ' ' O ' ' A' ' 100' ' ' GLU . 58.1 m170 -62.76 -41.01 99.02 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.613 -179.422 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 23.3 t -76.21 -42.39 46.26 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.888 0.375 . . . . 0.0 110.923 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 85.0 tt0 -62.89 -28.8 70.29 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.547 -179.615 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 84.8 t60 -51.28 -69.58 0.11 Allowed 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.193 -179.073 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 9.7 tp -62.66 -41.87 99.31 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.769 -0.372 . . . . 0.0 110.3 -179.555 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' HIS . . . . . 0.573 ' CG ' ' H ' ' A' ' 110' ' ' LEU . 20.8 t60 74.21 -165.47 0.09 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.724 179.92 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.573 ' H ' ' CG ' ' A' ' 109' ' ' HIS . 10.3 mp -62.18 -42.53 99.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.461 -179.922 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 91.15 175.89 43.67 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 110.864 -0.894 . . . . 0.0 110.864 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.512 ' N ' ' CD2' ' A' ' 112' ' ' LEU . 3.9 mm? -63.39 -41.89 98.78 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.961 0.41 . . . . 0.0 110.812 -179.684 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 83.5 p -68.06 146.7 53.24 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.398 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 44.6 t0 -171.57 -90.08 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.521 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.464 ' NH1' ' CE1' ' A' ' 116' ' ' HIS . 73.1 ttp85 -76.4 138.36 40.34 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.512 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . 0.464 ' CE1' ' NH1' ' A' ' 115' ' ' ARG . 32.5 m170 49.02 59.18 17.45 Favored Pre-proline 0 C--N 1.331 -0.207 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.55 179.817 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -69.97 -21.46 32.47 Favored 'Trans proline' 0 C--N 1.307 -1.609 0 C-N-CA 122.624 2.216 . . . . 0.0 112.001 -179.741 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 19.4 m -75.67 154.24 36.66 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.56 -179.651 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -152.06 148.38 27.61 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.494 179.873 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.767 0 CA-C-O 117.923 -1.487 . . . . 0.0 110.995 179.97 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.263 0 N-CA-C 109.549 -1.421 . . . . 0.0 109.549 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 99.7 m-70 42.11 -122.32 0.59 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.717 0.294 . . . . 0.0 110.632 -179.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 123' ' ' GLY . . . . . . . . . . . . . . . 69.95 28.98 71.12 Favored Glycine 0 CA--C 1.523 0.564 0 N-CA-C 110.818 -0.913 . . . . 0.0 110.818 179.91 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 35.4 m -69.3 132.35 33.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.829 0.347 . . . . 0.0 110.565 -179.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 125' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -90.08 -172.98 3.69 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.501 179.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 126' ' ' GLY . . . . . 0.533 ' O ' ' N ' ' B' ' 128' ' ' ASN . . . -162.09 -118.3 0.46 Allowed Glycine 0 CA--C 1.522 0.53 0 N-CA-C 110.824 -0.911 . . . . 0.0 110.824 -179.936 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 127' ' ' ARG . . . . . . . . . . . . . 75.7 ttt180 41.53 -90.34 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.709 0.29 . . . . 0.0 110.804 -179.651 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 128' ' ' ASN . . . . . 0.533 ' N ' ' O ' ' B' ' 126' ' ' GLY . 14.3 m120 45.44 -169.43 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.499 179.976 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 129' ' ' ARG . . . . . . . . . . . . . 66.8 mtt85 54.9 76.33 0.52 Allowed Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.598 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -60.94 145.29 99.29 Favored 'Trans proline' 0 C--N 1.307 -1.65 0 C-N-CA 122.915 2.41 . . . . 0.0 111.983 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 57.6 p 42.48 72.3 0.18 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.619 179.739 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 132' ' ' ALA . . . . . 0.622 ' N ' ' CD ' ' B' ' 133' ' ' PRO . . . -98.96 -42.39 0.23 Allowed Pre-proline 0 N--CA 1.467 0.41 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.273 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 133' ' ' PRO . . . . . 0.622 ' CD ' ' N ' ' B' ' 132' ' ' ALA . 25.3 Cg_exo -62.66 37.45 0.08 OUTLIER 'Trans proline' 0 C--N 1.311 -1.418 0 C-N-CA 122.994 2.463 . . . . 0.0 112.064 -179.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 134' ' ' LEU . . . . . 0.545 ' H ' ' C ' ' B' ' 132' ' ' ALA . 84.6 mt -70.48 135.97 49.07 Favored 'General case' 0 CA--C 1.512 -0.496 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 -179.736 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 135' ' ' ASP . . . . . 0.43 ' C ' ' O ' ' B' ' 134' ' ' LEU . 67.7 t0 -33.87 -33.22 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.269 0 O-C-N 123.508 0.505 . . . . 0.0 110.668 -179.609 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 136' ' ' SER . . . . . 0.497 ' N ' ' O ' ' B' ' 134' ' ' LEU . 57.4 p -45.55 -50.82 12.69 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.252 179.107 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -63.94 -42.52 97.3 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.074 179.681 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 138' ' ' ALA . . . . . . . . . . . . . . . -56.74 -35.61 68.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.207 179.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -66.69 -52.83 40.21 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 179.37 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -61.48 -40.33 94.14 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.71 -179.676 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -61.79 -52.02 65.92 Favored 'General case' 0 C--O 1.242 0.665 0 CA-C-O 121.233 0.54 . . . . 0.0 110.53 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 142' ' ' VAL . . . . . . . . . . . . . 90.3 t -62.18 -46.12 97.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.024 179.611 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -52.89 -43.26 66.04 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 120.86 0.362 . . . . 0.0 110.256 179.693 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 11.6 t -59.47 -43.34 93.26 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.006 179.782 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 26.7 m -62.87 -50.98 68.78 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 120.586 -0.446 . . . . 0.0 110.589 179.466 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 146' ' ' LEU . . . . . 0.45 ' N ' ' CD1' ' B' ' 146' ' ' LEU . 7.7 mp -65.86 -20.56 66.28 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.69 -0.232 . . . . 0.0 110.773 179.643 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 147' ' ' GLN . . . . . . . . . . . . . 59.3 tt0 -74.51 -59.79 2.57 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.604 179.434 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -60.43 -55.05 38.24 Favored 'General case' 0 CA--C 1.522 -0.117 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.8 -179.263 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 149' ' ' LEU . . . . . 0.462 ' O ' ' O ' ' B' ' 150' ' ' ALA . 3.9 mm? -47.62 -29.53 3.0 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.239 -179.341 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 150' ' ' ALA . . . . . 0.462 ' O ' ' O ' ' B' ' 149' ' ' LEU . . . -59.33 -143.51 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.203 0.525 . . . . 0.0 110.308 179.422 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 151' ' ' THR . . . . . . . . . . . . . 2.6 m 61.67 116.06 0.02 OUTLIER Pre-proline 0 C--N 1.322 -0.602 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.167 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_exo -48.4 -52.0 9.2 Favored 'Trans proline' 0 C--N 1.31 -1.496 0 C-N-CA 122.319 2.013 . . . . 0.0 113.364 -179.011 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 78.0 p -54.64 -48.4 72.31 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.027 -178.43 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 82.3 mtp180 -67.17 -37.73 84.22 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 120.853 -0.339 . . . . 0.0 110.588 -179.824 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 155' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.73 -53.39 57.95 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 120.431 -0.508 . . . . 0.0 110.802 -178.491 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 4.5 ttt -61.06 -47.14 87.71 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.782 -179.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 96.1 mt -61.47 -44.56 98.77 Favored 'Isoleucine or valine' 0 C--O 1.243 0.749 0 CA-C-O 121.399 0.618 . . . . 0.0 110.356 -179.574 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 33.7 mt -61.89 -40.13 94.35 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.151 179.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 16.2 m -60.47 -41.53 94.34 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.055 -0.521 . . . . 0.0 109.829 179.386 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 68.2 tp60 -57.06 -46.86 82.13 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.918 179.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 161' ' ' LEU . . . . . . . . . . . . . 32.6 mt -66.26 -38.6 88.22 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.836 179.376 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 162' ' ' ARG . . . . . . . . . . . . . 55.9 ttp180 -55.12 -43.76 74.39 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.226 -178.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -134.67 64.59 1.59 Allowed 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.948 0.404 . . . . 0.0 110.204 179.704 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . 173.8 77.58 0.05 OUTLIER Glycine 0 CA--C 1.531 1.037 0 N-CA-C 110.774 -0.931 . . . . 0.0 110.774 -179.762 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -75.35 106.4 2.26 Favored 'Trans proline' 0 N--CA 1.494 1.536 0 C-N-CA 122.547 2.165 . . . . 0.0 111.677 -179.541 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -158.41 154.45 23.58 Favored Pre-proline 0 C--N 1.325 -0.5 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.425 -179.342 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -64.6 176.89 2.51 Favored 'Trans proline' 0 C--N 1.309 -1.52 0 C-N-CA 122.834 2.356 . . . . 0.0 112.218 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 168' ' ' VAL . . . . . 0.492 ' CG2' ' N ' ' B' ' 169' ' ' THR . 4.3 m -67.51 -45.52 85.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.885 -179.815 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 169' ' ' THR . . . . . 0.492 ' N ' ' CG2' ' B' ' 168' ' ' VAL . 0.0 OUTLIER -57.63 -41.35 81.17 Favored 'General case' 0 C--O 1.246 0.9 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.349 -179.632 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 38.0 t0 -72.67 -37.81 67.81 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.527 178.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 8.6 tt -64.39 -38.41 90.92 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.171 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 172' ' ' ALA . . . . . . . . . . . . . . . -63.81 -45.31 90.2 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.264 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -60.91 -42.37 97.93 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.342 -0.543 . . . . 0.0 110.292 179.67 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -67.7 -52.28 39.61 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.927 -179.463 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 175' ' ' ILE . . . . . 0.434 ' CG2' ' O ' ' B' ' 175' ' ' ILE . 4.8 tt -174.57 85.7 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.771 -179.745 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . -168.71 -61.38 0.03 OUTLIER Glycine 0 C--N 1.315 -0.596 0 N-CA-C 110.527 -1.029 . . . . 0.0 110.527 178.532 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 64.5 mtm 56.17 29.61 15.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.792 0.329 . . . . 0.0 110.492 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 178' ' ' GLU . . . . . 0.525 ' O ' ' N ' ' B' ' 180' ' ' SER . 20.8 pt-20 -163.19 39.93 0.1 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.625 -179.816 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -40.75 -22.4 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.561 179.738 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 180' ' ' SER . . . . . 0.525 ' N ' ' O ' ' B' ' 178' ' ' GLU . 77.3 p -68.41 -42.68 78.65 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.383 179.686 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 181' ' ' ALA . . . . . 0.478 ' N ' ' O ' ' B' ' 178' ' ' GLU . . . -66.16 -35.56 80.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.348 179.556 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 99.0 t -66.96 -48.07 80.53 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.643 179.884 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 69.6 m -60.02 -43.44 95.27 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.841 0.353 . . . . 0.0 110.517 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 184' ' ' HIS . . . . . 0.512 ' ND1' ' O ' ' B' ' 180' ' ' SER . 33.8 m80 -63.37 -50.27 70.56 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-O 121.155 0.502 . . . . 0.0 110.739 -179.817 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 -63.62 -36.83 85.11 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.41 179.667 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 5.6 tt -62.47 -44.51 96.23 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.548 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 19.0 mmm180 -62.73 -42.15 99.52 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.863 0.363 . . . . 0.0 110.412 -179.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 71.5 t -62.13 -55.5 23.68 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 C-N-CA 119.989 -0.684 . . . . 0.0 110.066 -179.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 83.8 mt -60.67 -34.78 74.83 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.809 -0.441 . . . . 0.0 109.809 -179.629 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 76.3 ttt180 -58.13 -42.12 85.15 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.43 179.783 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -60.42 -46.47 89.91 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.582 -0.447 . . . . 0.0 110.445 -179.867 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 192' ' ' LEU . . . . . 0.497 ' CD2' ' N ' ' B' ' 192' ' ' LEU . 3.9 mm? -66.97 -41.69 86.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.658 179.56 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 109.14 93.38 2.27 Favored Glycine 0 CA--C 1.522 0.471 0 N-CA-C 110.85 -0.9 . . . . 0.0 110.85 -179.631 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 52.3 tp -158.83 -25.27 0.08 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.845 0.355 . . . . 0.0 110.542 179.491 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 24.1 m -137.95 159.82 33.35 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.346 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.407 179.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 196' ' ' VAL . . . . . 0.436 ' CG1' ' N ' ' B' ' 197' ' ' GLY . 73.8 t -145.35 159.16 13.13 Favored 'Isoleucine or valine' 0 C--O 1.232 0.137 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.361 -179.873 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 197' ' ' GLY . . . . . 0.436 ' N ' ' CG1' ' B' ' 196' ' ' VAL . . . -125.97 143.41 14.41 Favored Glycine 0 N--CA 1.463 0.45 0 N-CA-C 110.463 -1.055 . . . . 0.0 110.463 179.34 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 95.1 m-20 -117.27 138.49 51.7 Favored 'General case' 0 CA--C 1.514 -0.406 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 -179.57 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 52.7 ptt85 -108.52 144.51 36.08 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.798 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 200' ' ' ALA . . . . . . . . . . . . . . . -149.07 144.16 26.51 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.338 179.704 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 201' ' ' GLY . . . . . . . . . . . . . . . -41.33 -40.03 2.49 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 110.844 -0.902 . . . . 0.0 110.844 -179.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 202' ' ' ARG . . . . . 0.447 ' O ' ' OG ' ' B' ' 203' ' ' SER . 84.1 mtp180 -71.75 -44.6 63.79 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.921 -0.312 . . . . 0.0 110.889 179.628 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 203' ' ' SER . . . . . 0.447 ' OG ' ' O ' ' B' ' 202' ' ' ARG . 3.7 m 178.0 -179.57 0.28 Allowed 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 121.072 0.463 . . . . 0.0 109.813 -178.944 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -116.07 152.88 17.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 116.046 -0.524 . . . . 0.0 109.812 179.592 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 62.2 t -132.25 137.63 54.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.63 179.563 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 46.5 m-85 -100.8 132.63 46.1 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.205 178.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 43.2 t -150.97 171.12 17.79 Favored 'General case' 0 C--O 1.231 0.093 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.197 -179.741 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . 41.7 mt -70.59 150.84 45.65 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.384 -179.576 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -53.85 -51.76 62.55 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.657 -0.417 . . . . 0.0 110.462 -179.63 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -138.87 -174.86 3.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.273 -179.372 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 68.2 p -92.6 7.99 40.96 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.451 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 212' ' ' HIS . . . . . . . . . . . . . 18.8 t-160 -51.11 -68.38 0.17 Allowed 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.039 0.447 . . . . 0.0 110.47 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 25.1 m -62.9 -32.87 57.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.295 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 214' ' ' ALA . . . . . . . . . . . . . . . -58.05 -50.37 73.68 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.594 -179.812 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -65.59 -43.17 90.54 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.212 179.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 216' ' ' LEU . . . . . . . . . . . . . 15.1 tp -60.24 -46.1 90.96 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.339 -179.526 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 79.3 mt -64.13 -38.55 91.46 Favored 'General case' 0 C--O 1.221 -0.406 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.332 179.373 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 63.9 t0 -59.45 -45.01 92.81 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.477 -179.879 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 219' ' ' GLU . . . . . 0.434 ' O ' ' CG ' ' B' ' 223' ' ' HIS . 15.8 mm-40 -64.23 -49.94 69.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.531 -179.921 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -63.9 -40.97 97.73 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.328 -179.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 3.7 mm -63.45 -49.11 84.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 C-N-CA 120.639 -0.424 . . . . 0.0 110.764 -179.004 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -65.52 -44.56 86.55 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.836 0.351 . . . . 0.0 110.321 -179.799 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 223' ' ' HIS . . . . . 0.434 ' CG ' ' O ' ' B' ' 219' ' ' GLU . 62.3 m170 -61.81 -41.58 97.94 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.584 -179.485 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 5.5 t -75.07 -42.59 56.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.864 0.364 . . . . 0.0 111.153 179.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 80.0 tt0 -63.48 -26.86 68.91 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.462 -179.426 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 85.4 t60 -52.33 -70.29 0.09 Allowed 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 120.721 -0.391 . . . . 0.0 110.054 -179.032 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 227' ' ' LEU . . . . . . . . . . . . . 9.1 tp -62.92 -40.69 98.37 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.265 -179.615 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 228' ' ' HIS . . . . . 0.592 ' CG ' ' H ' ' B' ' 229' ' ' LEU . 23.1 t60 73.89 -164.64 0.09 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.631 179.913 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 229' ' ' LEU . . . . . 0.592 ' H ' ' CG ' ' B' ' 228' ' ' HIS . 10.4 mp -62.88 -41.96 99.6 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.343 -179.975 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . 92.54 175.29 41.69 Favored Glycine 0 CA--C 1.525 0.703 0 N-CA-C 110.791 -0.924 . . . . 0.0 110.791 -179.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 231' ' ' LEU . . . . . 0.514 ' CD2' ' N ' ' B' ' 231' ' ' LEU . 3.7 mm? -63.79 -41.02 98.01 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.953 0.406 . . . . 0.0 110.889 -179.775 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 232' ' ' SER . . . . . . . . . . . . . 12.1 p -69.84 147.51 50.26 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.357 -179.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 233' ' ' ASP . . . . . . . . . . . . . 64.2 t0 -170.94 -86.5 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.523 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 234' ' ' ARG . . . . . 0.417 ' NH1' ' CE1' ' B' ' 235' ' ' HIS . 73.1 ttp85 -79.38 137.25 37.22 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.459 -179.828 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 235' ' ' HIS . . . . . 0.417 ' CE1' ' NH1' ' B' ' 234' ' ' ARG . 36.1 m170 50.95 57.8 17.15 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.585 179.791 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 236' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -68.48 -21.75 39.84 Favored 'Trans proline' 0 C--N 1.308 -1.595 0 C-N-CA 122.781 2.321 . . . . 0.0 111.938 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 237' ' ' SER . . . . . . . . . . . . . 21.5 m -75.78 153.7 36.78 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.518 -179.675 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 238' ' ' ALA . . . . . . . . . . . . . . . -151.22 151.2 31.53 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.493 179.783 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.764 0 CA-C-O 118.021 -1.433 . . . . 0.0 110.917 -179.968 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 38.1 m-20 . . . . . 0 C--O 1.238 0.471 0 CA-C-O 121.36 0.6 . . . . 0.0 111.088 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 96.7 p -55.88 -28.39 56.39 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.254 -179.637 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 60.5 tp60 -70.91 -49.85 41.28 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.645 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.435 ' O ' HG23 ' A' ' 23' ' ' VAL . . . -55.34 -41.29 72.29 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 -179.741 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.8 -53.81 48.51 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 120.493 -0.483 . . . . 0.0 110.317 179.408 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.06 -47.73 80.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.9 0.381 . . . . 0.0 110.995 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 18.5 mm100 -56.58 -51.14 69.75 Favored 'General case' 0 C--O 1.24 0.604 0 CA-C-O 121.304 0.573 . . . . 0.0 110.488 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.435 HG23 ' O ' ' A' ' 19' ' ' ALA . 71.0 t -60.97 -43.12 95.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.814 179.674 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.485 ' HB2' HD12 ' B' ' 155' ' ' LEU . . . -50.83 -47.66 60.04 Favored 'General case' 0 C--O 1.223 -0.317 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.422 179.682 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 39.3 t -60.43 -43.15 97.08 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.084 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 21.7 m -63.34 -50.73 68.85 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.549 -0.46 . . . . 0.0 110.937 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 89.9 mt -70.13 -22.07 63.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.783 -179.487 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.488 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 55.3 tt0 -75.81 -55.1 5.96 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.661 178.946 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.48 -55.29 35.21 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 120.616 -0.434 . . . . 0.0 110.396 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.476 ' O ' ' O ' ' A' ' 31' ' ' ALA . 86.3 mt -45.99 -32.61 2.86 Favored 'General case' 0 CA--C 1.513 -0.447 0 C-N-CA 121.052 -0.259 . . . . 0.0 110.346 -179.202 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.488 ' HB3' ' O ' ' A' ' 28' ' ' GLN . . . -58.08 -126.84 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.282 179.575 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.512 ' HG1' ' HB3' ' A' ' 35' ' ' ARG . 0.6 OUTLIER 54.04 108.22 0.02 OUTLIER Pre-proline 0 CA--C 1.539 0.52 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.482 -179.721 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -48.77 -58.22 1.88 Allowed 'Trans proline' 0 N--CA 1.496 1.639 0 C-N-CA 122.265 1.977 . . . . 0.0 113.257 -179.752 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 5.4 t -57.26 -45.4 84.03 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.823 -178.803 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.512 ' HB3' ' HG1' ' A' ' 32' ' ' THR . 42.6 ttm180 -57.38 -44.05 84.12 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 120.806 -0.358 . . . . 0.0 110.778 -179.513 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.445 HD12 ' HB2' ' B' ' 143' ' ' ALA . 10.0 mt -62.64 -44.5 96.12 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.833 -0.347 . . . . 0.0 110.638 179.632 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 6.9 ttt -54.08 -48.77 70.31 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 120.371 -0.532 . . . . 0.0 110.222 179.844 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 47.8 mm -64.87 -43.03 96.37 Favored 'Isoleucine or valine' 0 C--O 1.236 0.39 0 CA-C-O 121.302 0.572 . . . . 0.0 110.528 179.387 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.614 ' O ' HD23 ' A' ' 39' ' ' LEU . 1.8 tt -61.6 -43.96 97.88 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.15 -179.308 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 12.0 m -59.26 -43.22 92.48 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.913 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 57.4 tp60 -55.56 -50.09 70.98 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.541 HD13 ' O ' ' A' ' 42' ' ' LEU . 0.2 OUTLIER -64.58 -42.92 95.3 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.96 0.886 . . . . 0.0 110.255 -179.498 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.51 ' O ' ' NE ' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -45.11 -35.79 3.31 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.389 -178.886 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 89.1 m-20 -61.29 -40.99 96.19 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.274 -179.779 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 167.1 170.9 32.55 Favored Glycine 0 CA--C 1.528 0.87 0 C-N-CA 120.549 -0.834 . . . . 0.0 111.25 178.782 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -62.6 150.49 87.59 Favored 'Trans proline' 0 N--CA 1.493 1.5 0 C-N-CA 122.733 2.289 . . . . 0.0 112.174 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 2.0 pp -175.14 145.03 0.85 Allowed Pre-proline 0 N--CA 1.449 -0.485 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.712 178.75 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -72.31 168.53 23.95 Favored 'Trans proline' 0 N--CA 1.498 1.742 0 C-N-CA 122.748 2.299 . . . . 0.0 112.28 178.846 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.5 HG23 ' N ' ' A' ' 50' ' ' THR . 9.0 m -63.26 -41.41 92.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.819 0.818 . . . . 0.0 110.603 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.5 ' N ' HG23 ' A' ' 49' ' ' VAL . 10.8 m -55.35 -41.01 71.95 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 114.756 -1.111 . . . . 0.0 110.479 179.538 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 89.2 m-20 -72.2 -42.92 65.26 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.086 0.47 . . . . 0.0 110.76 179.036 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.548 HD23 ' O ' ' A' ' 52' ' ' LEU . 1.1 tt -61.65 -36.14 79.94 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.088 -0.505 . . . . 0.0 109.91 -179.2 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.548 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -68.61 -48.51 63.92 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 116.175 -0.466 . . . . 0.0 109.854 179.818 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -53.15 -39.65 63.7 Favored 'General case' 0 C--O 1.232 0.166 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.392 179.529 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.47 -40.42 95.67 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.563 179.569 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 97.6 mt -89.89 -69.7 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.519 -0.227 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.362 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' GLY . . . . . 0.548 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 150.49 74.88 0.01 OUTLIER Glycine 0 CA--C 1.523 0.56 0 C-N-CA 120.869 -0.681 . . . . 0.0 111.677 179.421 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 34.2 ttm 61.27 77.01 0.35 Allowed 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.823 0.344 . . . . 0.0 110.968 179.036 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 88.1 mt-10 -150.29 21.57 0.84 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.694 179.653 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -60.44 -29.8 69.24 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.632 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 77.9 p -70.32 -45.91 65.27 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.641 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.415 ' O ' ' OE1' ' A' ' 66' ' ' GLN . . . -63.11 -32.06 73.35 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.926 179.79 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 77.1 t -69.18 -48.13 70.46 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.131 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.518 179.458 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 78.2 p -57.75 -41.88 82.82 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.642 -0.423 . . . . 0.0 110.424 -179.728 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' HIS . . . . . 0.432 ' O ' HG23 ' A' ' 69' ' ' VAL . 52.1 m80 -67.93 -43.67 78.61 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.945 179.606 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' GLN . . . . . 0.485 ' N ' ' OE1' ' A' ' 66' ' ' GLN . 0.7 OUTLIER -59.48 -51.62 69.09 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.022 0.439 . . . . 0.0 110.389 -179.242 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -61.51 -40.11 93.42 Favored 'General case' 0 CA--C 1.505 -0.761 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.267 -179.612 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -57.61 -44.84 85.77 Favored 'General case' 0 C--N 1.307 -1.28 0 CA-C-O 121.417 0.627 . . . . 0.0 110.446 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.432 HG23 ' O ' ' A' ' 65' ' ' HIS . 90.3 t -62.29 -53.97 40.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 C-N-CA 120.248 -0.581 . . . . 0.0 110.012 -179.775 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.456 ' O ' ' O ' ' A' ' 74' ' ' GLY . 4.2 mm? -61.51 -31.74 71.76 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.093 0.473 . . . . 0.0 110.242 -179.791 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.715 HH12 ' H ' ' A' ' 78' ' ' GLY . 59.9 ttt85 -59.29 -41.83 89.86 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.262 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 99.2 m-20 -63.72 -37.43 87.33 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.159 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.445 HD23 ' N ' ' A' ' 73' ' ' LEU . 5.8 mt -89.42 -7.08 55.89 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.458 -179.487 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' GLY . . . . . 0.596 ' C ' ' H ' ' A' ' 76' ' ' VAL . . . 89.56 -140.92 15.87 Favored Glycine 0 CA--C 1.521 0.43 0 N-CA-C 110.357 -1.097 . . . . 0.0 110.357 -179.814 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 38.2 mt 67.29 -29.47 0.15 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.727 0.298 . . . . 0.0 110.528 -179.64 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.596 ' H ' ' C ' ' A' ' 74' ' ' GLY . 3.3 m -134.34 156.67 40.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.148 179.486 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 54.7 t -137.7 146.99 26.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.367 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' GLY . . . . . 0.715 ' H ' HH12 ' A' ' 71' ' ' ARG . . . -121.47 140.92 14.25 Favored Glycine 0 C--N 1.335 0.514 0 N-CA-C 110.161 -1.176 . . . . 0.0 110.161 179.162 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 99.9 m-20 . . . . . 0 N--CA 1.466 0.345 0 CA-C-O 120.9 0.381 . . . . 0.0 110.384 -179.886 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 84.3 t . . . . . 0 N--CA 1.461 0.089 0 N-CA-C 110.24 -0.281 . . . . 0.0 110.24 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.514 ' O ' HD21 ' A' ' 42' ' ' LEU . 80.7 m-85 -106.37 131.63 53.36 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.384 179.685 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 93.7 p -150.16 170.47 18.87 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-O 120.842 0.354 . . . . 0.0 110.191 -179.486 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.662 ' N ' HD22 ' A' ' 89' ' ' LEU . 3.5 mm? -72.31 148.02 45.79 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.537 -179.576 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 26.4 t80 -51.7 -47.46 63.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.187 -179.771 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.49 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 19.7 p-10 -153.49 179.19 9.03 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.703 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' THR . . . . . 0.467 ' O ' ' HB3' ' A' ' 95' ' ' ALA . 81.3 p -76.57 -17.91 58.95 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.609 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 93' ' ' HIS . . . . . 0.435 ' CD2' ' C ' ' A' ' 93' ' ' HIS . 12.1 t-160 -38.83 -69.39 0.13 Allowed 'General case' 0 C--O 1.236 0.368 0 CA-C-O 121.015 0.436 . . . . 0.0 110.777 -179.884 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 83.0 t -51.59 -41.16 27.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.969 -179.73 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.467 ' HB3' ' O ' ' A' ' 92' ' ' THR . . . -56.85 -47.82 79.5 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.666 -179.931 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 99.0 mm-40 -58.21 -47.81 82.33 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.122 -179.612 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.514 ' CD1' ' HB2' ' B' ' 220' ' ' ALA . 15.4 tp -59.38 -43.66 92.87 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.048 -179.577 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 87.1 mt -63.7 -40.37 96.62 Favored 'General case' 0 C--O 1.221 -0.427 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.433 179.812 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -59.02 -42.78 91.02 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.622 -179.486 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.516 ' O ' ' ND1' ' A' ' 104' ' ' HIS . 72.6 mm-40 -67.2 -48.69 67.13 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.786 -0.366 . . . . 0.0 110.764 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' ALA . . . . . 0.605 ' HB2' ' CD1' ' B' ' 216' ' ' LEU . . . -64.88 -50.57 66.07 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.159 -179.623 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.534 ' O ' HD13 ' A' ' 102' ' ' ILE . 0.3 OUTLIER -62.36 -45.93 97.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 C-N-CA 120.396 -0.522 . . . . 0.0 110.769 -178.687 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 103' ' ' TYR . . . . . 0.52 ' N ' ' CG2' ' A' ' 102' ' ' ILE . 75.3 t80 -63.01 -49.31 75.14 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.117 -178.678 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 104' ' ' HIS . . . . . 0.516 ' ND1' ' O ' ' A' ' 100' ' ' GLU . 23.6 m80 -63.34 -37.22 86.41 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.737 -179.84 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 5.0 t -74.95 -44.07 50.58 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.946 0.403 . . . . 0.0 111.261 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 10.2 tm-20 -69.39 -21.59 63.77 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.566 -179.636 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' HIS . . . . . 0.421 ' C ' ' ND1' ' A' ' 107' ' ' HIS . 0.3 OUTLIER . . . . . 0 N--CA 1.452 -0.333 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.344 -179.091 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 36.3 m-20 . . . . . 0 C--O 1.238 0.47 0 CA-C-O 121.283 0.563 . . . . 0.0 110.991 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 92.1 p -57.21 -28.72 63.13 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.333 -179.584 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 10.3 tp-100 -70.66 -49.59 45.68 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.66 179.711 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 138' ' ' ALA . . . . . 0.444 ' O ' HG23 ' B' ' 142' ' ' VAL . . . -55.69 -40.28 72.14 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 120.705 -0.398 . . . . 0.0 109.93 -179.614 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -63.07 -53.41 54.05 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 120.547 -0.461 . . . . 0.0 110.237 179.21 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -57.24 -47.5 81.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.867 0.365 . . . . 0.0 110.86 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 88.0 mm-40 -55.99 -50.98 69.34 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-O 121.278 0.561 . . . . 0.0 110.452 -179.782 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 142' ' ' VAL . . . . . 0.444 HG23 ' O ' ' B' ' 138' ' ' ALA . 76.5 t -61.96 -42.95 96.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.864 179.734 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 143' ' ' ALA . . . . . 0.445 ' HB2' HD12 ' A' ' 36' ' ' LEU . . . -50.23 -48.6 54.4 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.269 179.561 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 38.1 t -60.42 -43.53 96.67 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.168 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 27.5 m -62.57 -50.48 71.13 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 120.556 -0.458 . . . . 0.0 111.026 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 91.3 mt -70.53 -21.6 62.71 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.901 -179.691 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 147' ' ' GLN . . . . . 0.469 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 58.3 tt0 -75.24 -56.98 4.18 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.561 179.144 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -59.65 -54.69 43.52 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.441 -179.454 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.487 ' O ' ' O ' ' B' ' 150' ' ' ALA . 81.0 mt -45.74 -34.5 3.65 Favored 'General case' 0 CA--C 1.514 -0.437 0 C-N-CA 120.976 -0.29 . . . . 0.0 110.455 -178.996 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 150' ' ' ALA . . . . . 0.487 ' O ' ' O ' ' B' ' 149' ' ' LEU . . . -57.57 -126.04 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.225 179.582 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 151' ' ' THR . . . . . 0.435 ' O ' ' O ' ' B' ' 150' ' ' ALA . 0.6 OUTLIER 54.35 108.22 0.02 OUTLIER Pre-proline 0 C--N 1.323 -0.579 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.49 -179.596 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_exo -48.26 -60.05 1.02 Allowed 'Trans proline' 0 N--CA 1.495 1.569 0 C-N-CA 122.256 1.97 . . . . 0.0 113.389 -179.769 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 39.8 t -56.64 -45.3 81.68 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.825 -178.736 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 154' ' ' ARG . . . . . 0.403 ' HB3' ' HG1' ' B' ' 151' ' ' THR . 42.0 ttm180 -57.17 -43.5 82.65 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 120.796 -0.362 . . . . 0.0 110.624 -179.583 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 155' ' ' LEU . . . . . 0.485 HD12 ' HB2' ' A' ' 24' ' ' ALA . 10.0 mt -63.1 -44.22 96.3 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.809 -0.357 . . . . 0.0 110.642 179.64 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 6.3 ttt -53.69 -48.76 69.22 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.358 -0.537 . . . . 0.0 110.158 179.739 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 41.8 mm -64.87 -43.43 96.33 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 CA-C-O 121.278 0.561 . . . . 0.0 110.524 179.431 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 158' ' ' LEU . . . . . 0.617 HD23 ' O ' ' B' ' 158' ' ' LEU . 1.7 tt -61.48 -43.5 98.76 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.064 -179.217 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 17.6 m -59.38 -43.51 92.88 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.033 -0.531 . . . . 0.0 109.996 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 61.3 tp60 -55.89 -49.97 71.93 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 120.483 -0.487 . . . . 0.0 109.811 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 161' ' ' LEU . . . . . 0.55 HD13 ' O ' ' B' ' 161' ' ' LEU . 0.2 OUTLIER -64.31 -41.83 96.63 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.733 0.778 . . . . 0.0 110.159 -179.454 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 162' ' ' ARG . . . . . 0.532 ' NE ' ' O ' ' B' ' 162' ' ' ARG . 0.0 OUTLIER -45.56 -36.4 4.63 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.261 -179.006 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -60.99 -41.64 96.89 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.214 -179.609 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . 167.61 171.85 34.05 Favored Glycine 0 CA--C 1.528 0.862 0 C-N-CA 120.582 -0.818 . . . . 0.0 111.341 178.817 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_exo -64.12 150.84 87.51 Favored 'Trans proline' 0 N--CA 1.494 1.508 0 C-N-CA 122.836 2.357 . . . . 0.0 112.215 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 1.8 pp -174.85 146.46 1.0 Allowed Pre-proline 0 C--N 1.326 -0.455 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.753 178.918 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -71.74 166.83 28.27 Favored 'Trans proline' 0 N--CA 1.495 1.614 0 C-N-CA 122.831 2.354 . . . . 0.0 112.316 178.874 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 168' ' ' VAL . . . . . 0.502 HG23 ' N ' ' B' ' 169' ' ' THR . 10.1 m -62.32 -40.9 89.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.83 0.824 . . . . 0.0 110.636 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 169' ' ' THR . . . . . 0.502 ' N ' HG23 ' B' ' 168' ' ' VAL . 7.4 m -56.83 -38.8 73.13 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 114.745 -1.116 . . . . 0.0 110.294 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 27.5 m-20 -71.7 -44.33 64.39 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.201 0.524 . . . . 0.0 110.335 179.346 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 171' ' ' LEU . . . . . 0.455 HD23 ' O ' ' B' ' 171' ' ' LEU . 0.7 OUTLIER -61.06 -32.54 72.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.16 -179.498 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 172' ' ' ALA . . . . . 0.541 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -70.99 -50.09 38.13 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.86 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -52.83 -38.82 61.86 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 120.515 -0.474 . . . . 0.0 110.336 179.607 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -64.76 -41.66 95.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.64 179.565 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 96.7 mt -89.4 -68.94 0.64 Allowed 'Isoleucine or valine' 0 CA--C 1.521 -0.139 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.329 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 176' ' ' GLY . . . . . 0.541 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 150.18 74.38 0.01 OUTLIER Glycine 0 CA--C 1.523 0.587 0 C-N-CA 120.959 -0.639 . . . . 0.0 111.633 179.373 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 33.4 ttm 61.38 78.15 0.3 Allowed 'General case' 0 C--O 1.232 0.148 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.866 179.293 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 88.2 mt-10 -150.56 23.09 0.8 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.628 179.77 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -61.78 -29.24 70.01 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.452 179.808 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 180' ' ' SER . . . . . 0.446 ' O ' ' ND1' ' B' ' 184' ' ' HIS . 78.3 p -70.28 -46.74 63.72 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.891 0.377 . . . . 0.0 110.463 -179.527 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 181' ' ' ALA . . . . . 0.409 ' O ' ' OE1' ' B' ' 185' ' ' GLN . . . -63.56 -30.97 72.01 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.931 179.691 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 54.2 t -69.34 -49.32 61.59 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.199 0 CA-C-O 121.135 0.493 . . . . 0.0 110.688 179.464 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 78.9 p -58.56 -40.61 83.53 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.653 -0.419 . . . . 0.0 110.463 -179.642 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 184' ' ' HIS . . . . . 0.446 ' ND1' ' O ' ' B' ' 180' ' ' SER . 51.4 m80 -67.92 -43.18 79.8 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.983 179.703 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 185' ' ' GLN . . . . . 0.476 ' N ' ' OE1' ' B' ' 185' ' ' GLN . 0.7 OUTLIER -60.49 -51.37 69.74 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.038 0.447 . . . . 0.0 110.491 -179.247 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -61.59 -39.65 91.97 Favored 'General case' 0 CA--C 1.506 -0.748 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.007 -179.572 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 15.1 tpt180 -57.91 -45.19 86.86 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-O 121.495 0.664 . . . . 0.0 110.46 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 73.9 t -62.21 -53.67 44.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 C-N-CA 120.159 -0.617 . . . . 0.0 109.96 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 189' ' ' LEU . . . . . 0.455 ' O ' ' O ' ' B' ' 193' ' ' GLY . 4.3 mm? -61.04 -31.88 71.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.09 0.472 . . . . 0.0 110.155 -179.751 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 190' ' ' ARG . . . . . 0.803 HH12 ' H ' ' B' ' 197' ' ' GLY . 60.4 ttt85 -59.61 -41.97 91.58 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.331 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 -63.57 -37.02 85.75 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 120.734 -0.386 . . . . 0.0 110.346 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 192' ' ' LEU . . . . . 0.454 ' N ' HD23 ' B' ' 192' ' ' LEU . 5.7 mt -89.56 -8.78 51.97 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.612 -179.364 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 193' ' ' GLY . . . . . 0.604 ' C ' ' H ' ' B' ' 195' ' ' VAL . . . 91.8 -141.72 15.75 Favored Glycine 0 CA--C 1.52 0.365 0 N-CA-C 110.389 -1.084 . . . . 0.0 110.389 -179.787 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 30.6 mt 67.86 -29.82 0.16 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.759 0.314 . . . . 0.0 110.613 -179.831 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 195' ' ' VAL . . . . . 0.604 ' H ' ' C ' ' B' ' 193' ' ' GLY . 3.1 m -136.18 158.34 38.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.29 179.735 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 196' ' ' VAL . . . . . . . . . . . . . 77.5 t -140.99 153.7 20.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.318 179.257 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 197' ' ' GLY . . . . . 0.803 ' H ' HH12 ' B' ' 190' ' ' ARG . . . -126.04 144.17 14.92 Favored Glycine 0 N--CA 1.464 0.505 0 N-CA-C 110.362 -1.095 . . . . 0.0 110.362 179.614 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 33.9 m-20 . . . . . 0 N--CA 1.465 0.316 0 CA-C-O 120.89 0.376 . . . . 0.0 110.614 179.904 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 96.6 t . . . . . 0 C--O 1.228 -0.073 0 N-CA-C 110.151 -0.314 . . . . 0.0 110.151 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 206' ' ' TYR . . . . . 0.439 ' O ' HD21 ' B' ' 161' ' ' LEU . 85.7 m-85 -106.92 132.52 52.78 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.418 179.716 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 51.5 p -151.36 171.36 17.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.281 -179.625 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 208' ' ' LEU . . . . . 0.682 HD22 ' N ' ' B' ' 208' ' ' LEU . 3.5 mm? -73.62 148.52 42.78 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.814 -179.692 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 23.4 t80 -51.63 -47.81 63.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.271 -179.806 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 210' ' ' ASP . . . . . 0.518 ' N ' ' OD1' ' B' ' 210' ' ' ASP . 14.3 p-10 -153.07 -179.46 7.71 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.809 0.338 . . . . 0.0 110.655 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 211' ' ' THR . . . . . 0.466 ' O ' ' HB3' ' B' ' 214' ' ' ALA . 65.1 p -77.81 -16.94 57.97 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.531 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 212' ' ' HIS . . . . . 0.412 ' NE2' ' CB ' ' A' ' 104' ' ' HIS . 11.9 t-160 -39.4 -69.63 0.12 Allowed 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.079 0.466 . . . . 0.0 110.831 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 87.0 t -50.75 -41.56 21.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.924 -179.73 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 214' ' ' ALA . . . . . 0.466 ' HB3' ' O ' ' B' ' 211' ' ' THR . . . -57.34 -47.2 82.19 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.918 0.389 . . . . 0.0 110.813 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -57.98 -47.39 83.13 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.138 -179.538 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 216' ' ' LEU . . . . . 0.605 ' CD1' ' HB2' ' A' ' 101' ' ' ALA . 14.1 tp -60.62 -43.56 97.36 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 120.449 -0.501 . . . . 0.0 110.049 -179.64 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 86.6 mt -63.56 -39.94 95.68 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.439 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -59.66 -42.08 92.02 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.487 -179.566 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 219' ' ' GLU . . . . . 0.459 ' O ' ' ND1' ' B' ' 223' ' ' HIS . 70.8 mm-40 -67.72 -49.2 63.86 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.796 -0.361 . . . . 0.0 110.742 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 220' ' ' ALA . . . . . 0.514 ' HB2' ' CD1' ' A' ' 97' ' ' LEU . . . -63.89 -51.3 65.16 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.986 -179.667 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 221' ' ' ILE . . . . . 0.553 HD13 ' O ' ' B' ' 221' ' ' ILE . 0.2 OUTLIER -62.26 -45.91 97.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 C-N-CA 120.419 -0.512 . . . . 0.0 110.667 -178.587 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 222' ' ' TYR . . . . . 0.508 ' N ' ' CG2' ' B' ' 221' ' ' ILE . 77.1 t80 -62.52 -49.29 75.95 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.06 -178.489 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 223' ' ' HIS . . . . . 0.459 ' ND1' ' O ' ' B' ' 219' ' ' GLU . 23.8 m80 -63.76 -36.54 84.21 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.737 -179.849 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 5.6 t -75.04 -44.66 46.5 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.927 0.394 . . . . 0.0 111.354 179.792 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 11.5 tm-20 -69.58 -21.67 63.59 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.596 -179.598 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.452 -0.346 0 C-N-CA 120.581 -0.448 . . . . 0.0 110.458 -179.145 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 . . . . . 0 C--O 1.234 0.245 0 CA-C-O 120.787 0.327 . . . . 0.0 110.927 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 11.9 t -58.22 -50.01 75.08 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.818 179.439 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -61.41 -43.13 99.4 Favored 'General case' 0 C--O 1.221 -0.407 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.393 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -55.3 -41.33 72.2 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.296 -179.714 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.05 -54.8 21.29 Favored 'General case' 0 C--N 1.333 -0.126 0 C-N-CA 120.672 -0.411 . . . . 0.0 110.835 179.752 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -58.58 -50.52 73.51 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.933 179.515 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.415 ' OE1' ' OG ' ' B' ' 224' ' ' SER . 54.5 tt0 -53.63 -50.69 65.15 Favored 'General case' 0 C--O 1.244 0.767 0 CA-C-O 121.061 0.458 . . . . 0.0 110.502 -179.766 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.432 ' O ' ' OG1' ' A' ' 26' ' ' THR . 49.1 t -61.5 -43.62 97.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.071 -0.513 . . . . 0.0 109.818 179.271 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.417 ' HB2' HD12 ' B' ' 155' ' ' LEU . . . -53.49 -47.24 70.0 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.308 -179.842 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 41.1 t -58.71 -43.66 90.17 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.508 -179.275 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.432 ' OG1' ' O ' ' A' ' 23' ' ' VAL . 12.7 p -65.45 -53.81 37.47 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 120.602 -0.439 . . . . 0.0 111.216 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.433 ' N ' ' CD1' ' A' ' 27' ' ' LEU . 8.0 mp -65.44 -23.13 66.86 Favored 'General case' 0 C--O 1.222 -0.39 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.941 -179.945 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.474 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 46.6 tt0 -73.11 -63.8 1.1 Allowed 'General case' 0 C--N 1.32 -0.682 0 O-C-N 123.39 0.431 . . . . 0.0 110.588 -179.817 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -54.94 -52.45 62.94 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.905 -179.111 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.405 ' O ' ' C ' ' A' ' 31' ' ' ALA . 4.1 mm? -53.44 -40.0 64.84 Favored 'General case' 0 CA--C 1.512 -0.516 0 C-N-CA 120.701 -0.399 . . . . 0.0 110.917 -179.636 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.587 ' O ' ' C ' ' A' ' 32' ' ' THR . . . -38.76 -73.1 0.05 Allowed 'General case' 0 CA--C 1.51 -0.59 0 O-C-N 123.637 0.585 . . . . 0.0 110.309 179.916 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.587 ' C ' ' O ' ' A' ' 31' ' ' ALA . 6.0 p -4.53 110.99 0.03 OUTLIER Pre-proline 0 CA--C 1.54 0.56 0 O-C-N 124.294 0.996 . . . . 0.0 111.134 179.241 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_exo -50.11 -45.52 32.81 Favored 'Trans proline' 0 C--N 1.303 -1.843 0 C-N-CA 122.231 1.954 . . . . 0.0 112.45 -177.682 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 66.7 m -56.98 -44.82 83.05 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.982 -179.105 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 77.6 mmt-85 -63.31 -38.32 90.7 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.063 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.424 ' CD1' ' O ' ' A' ' 31' ' ' ALA . 93.9 mt -64.66 -54.2 35.49 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.682 -0.407 . . . . 0.0 111.14 -179.614 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 10.7 tpt -54.34 -49.44 69.73 Favored 'General case' 0 C--O 1.239 0.539 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.394 -179.847 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 5.3 mm -62.77 -44.19 99.32 Favored 'Isoleucine or valine' 0 C--O 1.243 0.742 0 CA-C-O 121.22 0.533 . . . . 0.0 110.832 179.619 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 27.1 mt -61.41 -39.23 89.97 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.165 179.602 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 18.9 m -58.83 -40.37 83.99 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 179.554 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -60.55 -44.54 96.03 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 121.072 0.463 . . . . 0.0 110.077 179.827 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.511 HD21 HD13 ' A' ' 47' ' ' LEU . 13.8 mt -63.45 -37.94 89.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.746 179.158 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.425 ' C ' ' O ' ' A' ' 42' ' ' LEU . 77.4 ttt-85 -35.76 -30.04 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.482 -178.952 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.497 ' N ' ' O ' ' A' ' 42' ' ' LEU . 98.8 m-20 -65.34 -48.69 72.13 Favored 'General case' 0 C--N 1.334 -0.092 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.803 179.476 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.493 ' N ' ' O ' ' A' ' 42' ' ' LEU . . . 152.45 -79.52 0.2 Allowed Glycine 0 CA--C 1.528 0.863 0 N-CA-C 110.717 -0.953 . . . . 0.0 110.717 179.827 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -70.21 -172.88 0.67 Allowed 'Trans proline' 0 C--N 1.306 -1.692 0 C-N-CA 122.699 2.266 . . . . 0.0 111.937 179.513 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.511 HD13 HD21 ' A' ' 42' ' ' LEU . 6.8 tp -140.24 70.14 33.82 Favored Pre-proline 0 N--CA 1.454 -0.249 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.21 179.061 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_exo -62.42 91.73 0.13 Allowed 'Trans proline' 0 C--N 1.303 -1.839 0 C-N-CA 122.816 2.344 . . . . 0.0 110.973 177.442 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 55.0 t -55.91 -53.18 41.06 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 C-N-CA 120.639 -0.424 . . . . 0.0 111.62 -179.019 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.476 ' O ' ' OE1' ' A' ' 54' ' ' GLU . 29.0 p -63.07 -63.32 1.23 Allowed 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 120.894 0.378 . . . . 0.0 110.917 179.937 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.436 ' N ' ' OG1' ' A' ' 50' ' ' THR . 0.3 OUTLIER -46.14 -47.13 17.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.325 -178.723 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 68.1 mt -62.71 -38.62 91.16 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.582 179.184 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.431 ' HB3' ' O ' ' A' ' 50' ' ' THR . . . -54.13 -50.98 65.69 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.494 179.716 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.476 ' OE1' ' O ' ' A' ' 50' ' ' THR . 7.7 mp0 -63.77 -38.44 91.11 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.357 179.78 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ALA . . . . . 0.445 ' O ' HG23 ' A' ' 56' ' ' ILE . . . -57.21 -61.37 2.51 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 120.365 -0.534 . . . . 0.0 111.326 -179.125 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.445 HG23 ' O ' ' A' ' 55' ' ' ALA . 15.0 pt -156.89 -10.28 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.731 -179.772 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -61.23 -55.43 29.39 Favored Glycine 0 C--N 1.335 0.526 0 N-CA-C 110.924 -0.87 . . . . 0.0 110.924 -178.727 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 78.9 mtp 45.55 25.82 0.27 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.684 0.278 . . . . 0.0 110.475 179.341 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.531 ' HG2' ' H ' ' A' ' 62' ' ' ALA . 73.2 tt0 -171.73 84.5 0.08 Allowed 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 109.77 -0.455 . . . . 0.0 109.77 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -63.7 -30.38 71.49 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.249 -179.204 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 35.5 t -64.14 -36.3 83.59 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.503 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.531 ' H ' ' HG2' ' A' ' 59' ' ' GLU . . . -67.71 -33.59 75.2 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.657 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 73.6 t -73.06 -52.84 20.42 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.919 -179.603 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 77.4 p -58.7 -44.58 90.38 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.316 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -62.78 -50.42 71.11 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.545 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 32.5 tt0 -60.9 -39.71 90.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.395 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 48.8 tp -61.12 -43.42 98.9 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.331 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -61.51 -40.59 95.17 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.403 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 97.9 t -61.7 -54.67 31.69 Favored 'Isoleucine or valine' 0 N--CA 1.46 0.069 0 C-N-CA 120.208 -0.597 . . . . 0.0 110.398 -179.479 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 10.9 mp -61.84 -33.79 74.79 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 179.612 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 26.2 tpt85 -58.4 -41.91 85.98 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.356 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 99.8 m-20 -60.72 -44.15 96.97 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.238 -179.481 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.407 ' HG ' ' H ' ' A' ' 73' ' ' LEU . 10.3 mt -63.87 -40.16 95.89 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.223 -179.801 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 103.94 19.27 12.07 Favored Glycine 0 CA--C 1.522 0.529 0 N-CA-C 110.869 -0.893 . . . . 0.0 110.869 -179.772 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.3 tp -80.54 -6.01 57.59 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.034 0.445 . . . . 0.0 110.694 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 34.6 m -139.27 163.26 26.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.298 -179.858 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.591 HG12 ' N ' ' A' ' 78' ' ' GLY . 77.7 t -149.49 164.43 3.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.789 179.867 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' GLY . . . . . 0.591 ' N ' HG12 ' A' ' 77' ' ' VAL . . . -107.65 147.05 16.32 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 110.445 -1.062 . . . . 0.0 110.445 179.374 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 . . . . . 0 N--CA 1.466 0.353 0 CA-C-O 120.762 0.315 . . . . 0.0 110.771 -179.931 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 29.3 m . . . . . 0 C--O 1.224 -0.254 0 CA-C-O 120.773 0.321 . . . . 0.0 110.605 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 78.4 m-85 -98.09 131.99 44.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.3 -179.429 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 66.0 p -145.49 166.74 24.8 Favored 'General case' 0 C--O 1.224 -0.243 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.142 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 44.8 mt -65.79 145.0 56.51 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.556 -179.607 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 12.7 t80 -50.47 -47.09 57.19 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.403 -179.511 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 23.6 p30 -141.69 169.73 17.04 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.861 0.362 . . . . 0.0 110.454 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' THR . . . . . 0.514 ' O ' ' HB3' ' A' ' 95' ' ' ALA . 0.0 OUTLIER -85.71 -16.88 37.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.476 -179.756 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 -45.43 -65.02 0.6 Allowed 'General case' 0 C--O 1.237 0.429 0 CA-C-O 120.984 0.421 . . . . 0.0 110.589 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.419 HG13 ' N ' ' A' ' 95' ' ' ALA . 12.5 p -48.0 -36.63 5.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.303 -179.821 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.514 ' HB3' ' O ' ' A' ' 92' ' ' THR . . . -64.35 -37.64 88.24 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.241 179.452 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 66.5 tp60 -62.51 -47.28 84.65 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-O 121.275 0.56 . . . . 0.0 109.935 -179.595 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.61 HD21 ' HA ' ' B' ' 220' ' ' ALA . 7.1 mp -61.56 -42.75 99.3 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 120.424 -0.511 . . . . 0.0 110.214 -179.473 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 93.8 mt -66.97 -35.25 79.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.267 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 36.3 m-20 -60.78 -42.39 97.43 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.29 -0.413 . . . . 0.0 109.993 -179.408 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.497 ' C ' ' HD1' ' A' ' 104' ' ' HIS . 82.7 mt-10 -70.43 -52.81 19.56 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.383 179.197 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 101' ' ' ALA . . . . . 0.594 ' HA ' HD21 ' B' ' 216' ' ' LEU . . . -55.44 -45.81 76.79 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.627 179.563 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 5.1 mm -63.57 -44.92 98.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.87 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 89.6 t80 -63.96 -47.02 82.09 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.145 0.497 . . . . 0.0 110.61 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' HIS . . . . . 0.497 ' HD1' ' C ' ' A' ' 100' ' ' GLU . 51.8 m80 -60.62 -36.09 77.76 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.472 -179.735 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.421 ' OG ' ' OE1' ' B' ' 141' ' ' GLN . 38.9 t -76.52 -46.88 24.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.873 179.562 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -55.59 -28.21 53.77 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.359 -179.635 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 52.8 t-80 . . . . . 0 C--N 1.33 -0.25 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.685 179.708 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 . . . . . 0 C--O 1.238 0.476 0 CA-C-O 121.279 0.561 . . . . 0.0 110.591 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 11.4 t -59.26 -41.35 88.59 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.248 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -64.86 -46.28 82.51 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.44 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 138' ' ' ALA . . . . . . . . . . . . . . . -54.5 -41.56 69.75 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.183 -179.665 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -66.14 -54.3 27.17 Favored 'General case' 0 N--CA 1.457 -0.112 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.897 179.476 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -58.38 -51.27 70.54 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.976 179.594 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 141' ' ' GLN . . . . . 0.421 ' OE1' ' OG ' ' A' ' 105' ' ' SER . 57.1 tt0 -53.43 -49.86 66.44 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-O 121.084 0.469 . . . . 0.0 110.385 -179.747 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 142' ' ' VAL . . . . . . . . . . . . . 51.2 t -61.66 -43.25 96.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.699 179.186 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -54.44 -46.52 73.28 Favored 'General case' 0 C--O 1.217 -0.62 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.307 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 40.0 t -59.01 -44.01 91.64 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.508 -179.256 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 18.0 p -65.51 -53.8 37.26 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 120.619 -0.432 . . . . 0.0 111.216 179.875 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 146' ' ' LEU . . . . . 0.415 ' N ' ' CD1' ' B' ' 146' ' ' LEU . 8.2 mp -65.04 -23.11 67.09 Favored 'General case' 0 C--O 1.22 -0.453 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.016 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 147' ' ' GLN . . . . . 0.485 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 46.5 tt0 -73.66 -63.35 1.22 Allowed 'General case' 0 C--N 1.319 -0.741 0 O-C-N 123.364 0.415 . . . . 0.0 110.498 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -55.19 -52.92 61.8 Favored 'General case' 0 CA--C 1.521 -0.153 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.01 -179.085 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.411 ' O ' ' C ' ' B' ' 150' ' ' ALA . 4.1 mm? -52.96 -39.87 63.27 Favored 'General case' 0 CA--C 1.514 -0.429 0 C-N-CA 120.661 -0.415 . . . . 0.0 110.943 -179.773 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 150' ' ' ALA . . . . . 0.58 ' O ' ' C ' ' B' ' 151' ' ' THR . . . -39.19 -72.87 0.05 Allowed 'General case' 0 CA--C 1.511 -0.557 0 O-C-N 123.649 0.593 . . . . 0.0 110.285 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 151' ' ' THR . . . . . 0.58 ' C ' ' O ' ' B' ' 150' ' ' ALA . 6.8 p -4.77 110.3 0.03 OUTLIER Pre-proline 0 CA--C 1.54 0.582 0 O-C-N 124.279 0.987 . . . . 0.0 111.097 179.292 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_exo -49.4 -45.08 32.05 Favored 'Trans proline' 0 C--N 1.302 -1.875 0 C-N-CA 122.192 1.928 . . . . 0.0 112.487 -177.569 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 53.5 m -57.3 -44.85 84.45 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.983 -179.128 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 154' ' ' ARG . . . . . 0.621 ' NH1' HE21 ' B' ' 185' ' ' GLN . 77.2 mmt-85 -63.16 -39.01 93.42 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.996 -179.704 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 155' ' ' LEU . . . . . 0.417 HD12 ' HB2' ' A' ' 24' ' ' ALA . 94.4 mt -63.86 -54.41 35.27 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 120.733 -0.387 . . . . 0.0 111.102 -179.559 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 10.8 tpt -54.48 -49.65 69.61 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.489 -0.484 . . . . 0.0 110.461 -179.755 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 5.0 mm -62.21 -44.36 99.01 Favored 'Isoleucine or valine' 0 C--O 1.242 0.686 0 CA-C-O 121.328 0.585 . . . . 0.0 110.764 179.643 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 27.5 mt -61.81 -39.32 91.33 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.109 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 99.8 m -58.5 -40.64 83.39 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 179.662 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -60.73 -44.24 96.9 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 120.968 0.414 . . . . 0.0 109.927 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 161' ' ' LEU . . . . . 0.534 HD21 HD13 ' B' ' 166' ' ' LEU . 14.2 mt -63.72 -36.31 83.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.852 179.219 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 162' ' ' ARG . . . . . 0.421 ' C ' ' O ' ' B' ' 161' ' ' LEU . 77.4 ttt-85 -36.48 -30.63 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.471 -179.104 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 163' ' ' ASN . . . . . 0.476 ' N ' ' O ' ' B' ' 161' ' ' LEU . 96.4 m-20 -64.96 -50.25 67.15 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.834 179.81 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 164' ' ' GLY . . . . . 0.449 ' N ' ' O ' ' B' ' 161' ' ' LEU . . . 153.91 -78.01 0.2 Allowed Glycine 0 CA--C 1.528 0.891 0 N-CA-C 110.682 -0.967 . . . . 0.0 110.682 179.715 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -70.71 -171.43 0.55 Allowed 'Trans proline' 0 C--N 1.306 -1.709 0 C-N-CA 122.681 2.254 . . . . 0.0 111.96 179.793 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 166' ' ' LEU . . . . . 0.534 HD13 HD21 ' B' ' 161' ' ' LEU . 8.7 tp -142.25 69.9 22.34 Favored Pre-proline 0 C--N 1.331 -0.217 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.084 179.208 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_exo -63.02 91.83 0.14 Allowed 'Trans proline' 0 C--N 1.303 -1.863 0 C-N-CA 122.903 2.402 . . . . 0.0 111.123 177.774 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . 71.0 t -55.47 -53.29 37.62 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 C-N-CA 120.629 -0.429 . . . . 0.0 111.788 -178.863 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 169' ' ' THR . . . . . 0.476 ' O ' ' OE1' ' B' ' 173' ' ' GLU . 23.5 p -63.01 -63.1 1.3 Allowed 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.16 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 170' ' ' ASP . . . . . 0.442 ' N ' ' OG1' ' B' ' 169' ' ' THR . 0.8 OUTLIER -48.02 -44.97 31.44 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.159 -0.473 . . . . 0.0 109.966 -177.96 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 64.5 mt -63.52 -39.79 95.36 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.681 178.643 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 172' ' ' ALA . . . . . 0.409 ' HB3' ' O ' ' B' ' 169' ' ' THR . . . -53.31 -50.57 64.66 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.355 179.557 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 173' ' ' GLU . . . . . 0.476 ' OE1' ' O ' ' B' ' 169' ' ' THR . 8.7 mp0 -63.51 -38.86 92.77 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.382 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 174' ' ' ALA . . . . . 0.452 ' O ' HG23 ' B' ' 175' ' ' ILE . . . -56.76 -61.86 2.14 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 120.364 -0.534 . . . . 0.0 111.23 -179.077 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 175' ' ' ILE . . . . . 0.452 HG23 ' O ' ' B' ' 174' ' ' ALA . 15.5 pt -156.63 -9.76 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.752 -179.786 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . -61.51 -55.12 30.7 Favored Glycine 0 CA--C 1.521 0.467 0 N-CA-C 110.94 -0.864 . . . . 0.0 110.94 -178.755 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 76.5 mtp 45.43 26.37 0.29 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.706 0.288 . . . . 0.0 110.402 179.193 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 178' ' ' GLU . . . . . 0.471 ' HG2' ' H ' ' B' ' 181' ' ' ALA . 70.2 tt0 -172.6 85.34 0.06 Allowed 'General case' 0 CA--C 1.528 0.103 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -179.91 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -64.21 -29.84 70.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.289 -179.252 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 38.4 t -64.07 -37.74 88.54 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.534 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 181' ' ' ALA . . . . . 0.471 ' H ' ' HG2' ' B' ' 178' ' ' GLU . . . -66.71 -33.27 75.26 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.683 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 74.8 t -73.36 -53.05 19.22 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.15 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.866 -179.693 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 78.0 p -59.34 -44.03 92.7 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 -179.777 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 58.9 t-80 -63.9 -50.38 68.97 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-O 120.935 0.398 . . . . 0.0 110.653 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 185' ' ' GLN . . . . . 0.621 HE21 ' NH1' ' B' ' 154' ' ' ARG . 40.4 tt0 -61.27 -39.83 91.85 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.106 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 53.6 tp -60.92 -45.14 95.84 Favored 'General case' 0 C--O 1.222 -0.372 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.305 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -59.79 -41.66 91.67 Favored 'General case' 0 C--O 1.241 0.646 0 O-C-N 123.212 0.32 . . . . 0.0 110.415 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 88.1 t -59.26 -54.05 39.64 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.096 0 C-N-CA 120.241 -0.583 . . . . 0.0 110.076 -179.357 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 10.8 mp -62.13 -33.05 73.76 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.927 -0.398 . . . . 0.0 109.927 179.503 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -57.76 -41.41 81.88 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.26 -179.411 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -63.1 -40.48 97.77 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.425 -179.58 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 192' ' ' LEU . . . . . 0.412 ' N ' HD23 ' B' ' 192' ' ' LEU . 9.1 mt -66.27 -40.12 89.9 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.469 -179.489 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 103.44 17.13 18.41 Favored Glycine 0 CA--C 1.523 0.561 0 N-CA-C 110.923 -0.871 . . . . 0.0 110.923 -179.587 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 4.5 tp -80.24 -6.16 57.4 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.965 0.412 . . . . 0.0 110.656 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 34.3 m -138.67 162.5 29.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.33 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 196' ' ' VAL . . . . . 0.607 HG12 ' N ' ' B' ' 197' ' ' GLY . 71.3 t -149.28 164.16 4.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 120.905 0.384 . . . . 0.0 110.787 179.777 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 197' ' ' GLY . . . . . 0.607 ' N ' HG12 ' B' ' 196' ' ' VAL . . . -106.92 147.47 16.22 Favored Glycine 0 CA--C 1.523 0.575 0 N-CA-C 110.428 -1.069 . . . . 0.0 110.428 179.413 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 96.7 m-20 . . . . . 0 N--CA 1.466 0.359 0 CA-C-O 120.742 0.306 . . . . 0.0 110.579 -179.791 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 27.4 m . . . . . 0 N--CA 1.466 0.341 0 CA-C-O 120.899 0.38 . . . . 0.0 110.507 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 78.0 m-85 -97.58 131.18 44.41 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.229 -179.476 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 14.8 p -144.57 165.94 26.58 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.337 -179.739 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . 34.4 mt -65.51 146.01 55.39 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.485 -179.583 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 13.2 t80 -50.95 -48.46 60.93 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.337 -179.532 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 22.3 p30 -140.89 169.66 17.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.947 0.403 . . . . 0.0 110.441 -179.82 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 211' ' ' THR . . . . . 0.544 ' O ' ' HB3' ' B' ' 214' ' ' ALA . 0.1 OUTLIER -85.31 -17.28 37.31 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.384 -179.867 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 212' ' ' HIS . . . . . . . . . . . . . 85.3 m-70 -44.47 -65.49 0.51 Allowed 'General case' 0 C--O 1.237 0.412 0 CA-C-O 121.03 0.443 . . . . 0.0 110.569 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 11.4 p -48.28 -35.44 5.71 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.283 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 214' ' ' ALA . . . . . 0.544 ' HB3' ' O ' ' B' ' 211' ' ' THR . . . -64.79 -38.27 90.4 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.228 179.351 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 69.2 tp60 -62.21 -46.75 87.51 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 121.202 0.525 . . . . 0.0 110.021 -179.556 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 216' ' ' LEU . . . . . 0.594 HD21 ' HA ' ' A' ' 101' ' ' ALA . 6.8 mp -61.7 -43.54 98.67 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 120.437 -0.505 . . . . 0.0 110.239 -179.409 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 217' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' B' ' 217' ' ' LEU . 95.7 mt -66.1 -36.2 82.53 Favored 'General case' 0 C--O 1.222 -0.347 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.286 179.17 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 89.0 m-20 -59.76 -43.01 94.5 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.094 -179.434 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 219' ' ' GLU . . . . . 0.507 ' O ' ' ND1' ' B' ' 223' ' ' HIS . 96.7 mt-10 -69.57 -52.53 25.38 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.413 179.231 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 220' ' ' ALA . . . . . 0.61 ' HA ' HD21 ' A' ' 97' ' ' LEU . . . -56.5 -45.53 80.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.663 179.724 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 5.1 mm -63.27 -45.17 99.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.761 -179.74 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 91.0 t80 -63.91 -46.96 82.47 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.155 0.502 . . . . 0.0 110.676 179.646 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 223' ' ' HIS . . . . . 0.507 ' ND1' ' O ' ' B' ' 219' ' ' GLU . 46.2 m80 -60.36 -36.44 78.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.468 -179.623 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 224' ' ' SER . . . . . 0.415 ' OG ' ' OE1' ' A' ' 22' ' ' GLN . 10.2 t -76.36 -46.61 26.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.926 0.393 . . . . 0.0 110.836 179.643 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -55.44 -28.87 56.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.326 -179.492 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 55.6 t-80 . . . . . 0 C--N 1.332 -0.195 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.695 179.7 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 90.3 m-20 . . . . . 0 C--O 1.236 0.353 0 CA-C-O 121.123 0.487 . . . . 0.0 110.96 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 88.5 p -61.56 -37.51 84.08 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.347 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -66.17 -47.22 74.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.336 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.657 ' O ' HG23 ' A' ' 23' ' ' VAL . . . -56.24 -39.76 73.05 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.701 -0.4 . . . . 0.0 110.211 -179.753 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.565 ' HB1' ' HB3' ' B' ' 155' ' ' LEU . . . -64.04 -54.05 40.34 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.54 -0.464 . . . . 0.0 110.336 179.454 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -58.6 -47.93 82.68 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.29 -179.594 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -62.09 -50.97 69.81 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.984 -179.568 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.657 HG23 ' O ' ' A' ' 19' ' ' ALA . 95.1 t -61.25 -44.52 98.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.31 -179.699 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.1 -41.13 82.86 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.198 179.559 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 69.2 m -59.64 -43.64 93.79 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.137 179.616 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 85.7 m -62.91 -47.82 81.62 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.624 -0.43 . . . . 0.0 110.757 179.65 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 91.6 mt -67.82 -21.47 65.21 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.501 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.465 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 55.9 tt0 -75.33 -56.48 4.67 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.618 179.457 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.434 ' HB1' HH22 ' A' ' 35' ' ' ARG . . . -59.48 -53.9 52.78 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.614 -179.661 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.488 ' O ' ' O ' ' A' ' 31' ' ' ALA . 87.9 mt -47.13 -35.48 7.26 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 120.756 0.312 . . . . 0.0 110.196 -179.09 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.488 ' O ' ' O ' ' A' ' 30' ' ' LEU . . . -57.89 -140.35 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.44 179.103 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.432 ' O ' ' O ' ' A' ' 31' ' ' ALA . 47.2 m 57.65 112.75 0.02 OUTLIER Pre-proline 0 CA--C 1.54 0.574 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.98 -179.726 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' PRO . . . . . 0.419 ' O ' ' N ' ' A' ' 36' ' ' LEU . 51.3 Cg_exo -48.25 -59.07 1.38 Allowed 'Trans proline' 0 N--CA 1.495 1.617 0 C-N-CA 122.211 1.94 . . . . 0.0 113.306 -179.099 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 81.1 p -44.74 -48.36 10.78 Favored 'General case' 0 C--O 1.237 0.445 0 CA-C-O 121.18 0.514 . . . . 0.0 111.014 -178.66 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.434 HH22 ' HB1' ' A' ' 29' ' ' ALA . 84.2 mtp180 -72.46 -24.61 61.22 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.344 179.764 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.544 ' HB3' ' HB1' ' B' ' 139' ' ' ALA . 0.2 OUTLIER -67.2 -55.41 14.22 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 119.901 -0.72 . . . . 0.0 111.337 -178.542 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.417 ' HG2' ' H ' ' A' ' 37' ' ' MET . 5.2 ptp -64.78 -43.76 92.18 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.255 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 97.5 mt -63.12 -45.31 98.96 Favored 'Isoleucine or valine' 0 C--O 1.241 0.63 0 CA-C-O 121.415 0.626 . . . . 0.0 110.477 -179.313 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 5.3 tt -63.21 -41.23 99.11 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.599 179.72 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 31.7 m -59.26 -43.07 92.46 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.077 179.716 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 82.7 mm-40 -56.85 -45.32 82.49 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.545 -0.462 . . . . 0.0 110.019 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.413 ' HA ' HD23 ' A' ' 42' ' ' LEU . 31.7 mt -66.5 -40.08 89.05 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.509 -0.477 . . . . 0.0 110.979 179.006 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 73.8 ttp85 -60.24 -34.2 73.35 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.682 -179.564 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -57.15 -40.11 76.55 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.262 -179.559 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 167.45 170.54 32.4 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 111.052 -0.819 . . . . 0.0 111.052 179.752 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -65.6 144.08 77.39 Favored 'Trans proline' 0 C--N 1.307 -1.624 0 C-N-CA 122.779 2.319 . . . . 0.0 111.809 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 1.9 pp -175.09 146.65 0.96 Allowed Pre-proline 0 C--N 1.325 -0.47 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.869 179.785 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -72.17 167.39 26.95 Favored 'Trans proline' 0 N--CA 1.495 1.566 0 C-N-CA 122.821 2.347 . . . . 0.0 112.19 179.333 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.431 ' CG2' ' N ' ' A' ' 50' ' ' THR . 3.1 m -62.38 -38.41 81.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 121.494 0.664 . . . . 0.0 110.425 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.431 ' N ' ' CG2' ' A' ' 49' ' ' VAL . 73.9 m -58.67 -44.65 90.24 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 114.526 -1.216 . . . . 0.0 110.293 179.781 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.422 ' O ' ' OD1' ' A' ' 51' ' ' ASP . 64.8 t0 -68.21 -37.2 80.63 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.923 -0.581 . . . . 0.0 109.907 178.579 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.672 HD13 ' C ' ' A' ' 52' ' ' LEU . 3.1 tm? -62.83 -44.34 96.41 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 119.988 -0.685 . . . . 0.0 110.25 -179.561 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.02 -43.32 99.07 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.587 179.834 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -60.19 -49.11 78.91 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 120.332 -0.547 . . . . 0.0 110.527 179.676 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.72 -52.35 57.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.035 -179.509 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.686 HG23 ' O ' ' A' ' 56' ' ' ILE . 7.6 tt -176.02 87.76 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.458 -0.073 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.941 -179.461 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -164.92 -57.17 0.02 OUTLIER Glycine 0 CA--C 1.52 0.389 0 N-CA-C 110.353 -1.099 . . . . 0.0 110.353 178.137 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 66.5 mtt 53.73 27.54 7.07 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.285 179.639 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.478 ' HG2' ' H ' ' A' ' 62' ' ' ALA . 70.6 tt0 -165.72 89.35 0.43 Allowed 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -74.1 -21.91 59.7 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.84 -179.328 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 78.1 p -67.15 -41.74 85.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.792 -179.873 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.478 ' H ' ' HG2' ' A' ' 59' ' ' GLU . . . -67.14 -32.12 73.03 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.473 179.78 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 83.6 t -69.99 -51.79 36.7 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.24 0 CA-C-N 116.488 -0.323 . . . . 0.0 110.778 179.829 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 99.3 p -60.33 -38.59 84.23 Favored 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 120.766 -0.374 . . . . 0.0 110.448 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 56.7 t-80 -66.39 -49.94 65.14 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-O 121.036 0.446 . . . . 0.0 110.703 -179.76 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 91.2 mm-40 -63.65 -38.01 89.51 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.242 179.658 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.412 HD21 ' CD1' ' A' ' 87' ' ' TYR . 7.5 tp -61.82 -45.27 94.54 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.002 -0.544 . . . . 0.0 109.776 -179.811 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 60.9 ttt85 -60.63 -45.16 95.09 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.499 -0.48 . . . . 0.0 110.483 -179.621 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 85.5 t -62.74 -54.65 31.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 C-N-CA 120.093 -0.643 . . . . 0.0 110.145 -179.457 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 78.4 mt -58.64 -35.15 72.07 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.08 0.467 . . . . 0.0 110.057 -179.196 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 70.0 ttt180 -60.43 -40.54 91.41 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.304 179.515 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 40.9 t-20 -62.36 -44.03 97.43 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 120.45 -0.5 . . . . 0.0 110.483 -179.387 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.482 HD23 ' N ' ' A' ' 73' ' ' LEU . 6.4 mt -67.88 -39.9 83.61 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.347 -179.212 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 104.66 29.0 5.48 Favored Glycine 0 CA--C 1.526 0.779 0 N-CA-C 110.808 -0.917 . . . . 0.0 110.808 -179.774 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 92.5 mt -90.28 -19.35 24.2 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.869 0.366 . . . . 0.0 110.838 179.761 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 21.8 m -135.82 158.25 39.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.097 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.426 HG23 ' CD2' ' A' ' 90' ' ' TYR . 39.3 t -141.59 155.88 20.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.508 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' GLY . . . . . 0.416 ' N ' ' CG1' ' A' ' 77' ' ' VAL . . . -117.68 142.19 17.01 Favored Glycine 0 CA--C 1.524 0.649 0 N-CA-C 110.185 -1.166 . . . . 0.0 110.185 178.985 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 . . . . . 0 N--CA 1.466 0.326 0 CA-C-O 120.745 0.307 . . . . 0.0 110.311 179.896 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.8 m . . . . . 0 N--CA 1.467 0.393 0 CA-C-O 120.837 0.351 . . . . 0.0 110.589 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.412 ' CD1' HD21 ' A' ' 67' ' ' LEU . 63.1 m-85 -106.81 133.64 51.16 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.061 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 74.5 m -151.23 171.71 16.98 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 64.0 mt -63.99 150.56 44.97 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.584 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.426 ' CD2' HG23 ' A' ' 77' ' ' VAL . 5.5 t80 -52.73 -48.65 66.52 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.398 -179.5 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 90.3 m-20 -139.71 166.92 23.32 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.078 0.466 . . . . 0.0 110.572 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' THR . . . . . 0.481 ' O ' ' HB3' ' A' ' 95' ' ' ALA . 47.9 p -76.11 -24.22 54.96 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.835 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 93' ' ' HIS . . . . . 0.434 ' HB3' ' CD2' ' B' ' 223' ' ' HIS . 68.2 m80 -41.15 -60.12 1.32 Allowed 'General case' 0 C--O 1.237 0.416 0 CA-C-O 121.186 0.517 . . . . 0.0 110.72 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 10.8 m -55.81 -40.1 59.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.925 -0.58 . . . . 0.0 109.957 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.481 ' HB3' ' O ' ' A' ' 92' ' ' THR . . . -56.77 -41.15 77.1 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.987 0.422 . . . . 0.0 110.508 179.855 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.458 ' O ' ' OE1' ' A' ' 100' ' ' GLU . 6.1 tp-100 -64.76 -42.51 95.09 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.137 179.777 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 17.2 tp -59.6 -45.63 91.33 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.188 -0.605 . . . . 0.0 110.341 -178.78 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -65.51 -36.26 83.31 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.103 179.373 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 66.9 t0 -58.77 -43.17 90.33 Favored 'General case' 0 C--N 1.32 -0.706 0 C-N-CA 120.415 -0.514 . . . . 0.0 110.434 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.478 ' N ' ' OE1' ' A' ' 100' ' ' GLU . 2.7 mp0 -69.02 -50.41 49.04 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.484 179.786 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 101' ' ' ALA . . . . . 0.432 ' HB2' ' CD1' ' B' ' 216' ' ' LEU . . . -59.35 -44.67 92.64 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.759 -0.376 . . . . 0.0 110.38 -179.685 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.571 HD13 HG21 ' B' ' 142' ' ' VAL . 4.8 mm -62.76 -45.04 99.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 C-N-CA 120.666 -0.414 . . . . 0.0 110.42 -179.264 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 73.2 t80 -64.09 -44.45 92.29 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.057 0.456 . . . . 0.0 110.389 179.838 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' HIS . . . . . 0.551 ' CE1' ' CB ' ' B' ' 212' ' ' HIS . 25.7 t60 -59.14 -39.17 81.52 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.74 179.901 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 12.3 t -77.04 -44.57 30.28 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.918 0.39 . . . . 0.0 111.25 179.668 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 79.5 tt0 -55.82 -31.1 62.39 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.472 -179.173 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.328 -0.329 0 C-N-CA 120.388 -0.525 . . . . 0.0 110.195 -179.214 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 . . . . . 0 C--O 1.236 0.359 0 CA-C-O 121.117 0.484 . . . . 0.0 110.81 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 78.3 p -62.38 -37.0 84.06 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.328 179.741 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -66.2 -47.28 74.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.267 179.548 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 138' ' ' ALA . . . . . 0.652 ' O ' HG23 ' B' ' 142' ' ' VAL . . . -56.33 -39.61 73.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.076 -179.77 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 139' ' ' ALA . . . . . 0.544 ' HB1' ' HB3' ' A' ' 36' ' ' LEU . . . -64.23 -54.09 38.86 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.512 -0.475 . . . . 0.0 110.392 179.614 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -58.75 -48.03 82.61 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.326 -179.643 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -61.93 -51.21 69.06 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.22 0.533 . . . . 0.0 111.006 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 142' ' ' VAL . . . . . 0.652 HG23 ' O ' ' B' ' 138' ' ' ALA . 96.1 t -61.02 -44.3 97.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.214 -179.699 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -57.5 -41.53 80.95 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 110.062 -0.347 . . . . 0.0 110.062 179.717 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 68.0 m -59.54 -44.08 93.32 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.199 179.831 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 71.4 m -62.8 -48.51 78.81 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 120.99 0.424 . . . . 0.0 110.962 179.768 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 92.7 mt -67.38 -21.59 65.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.528 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 147' ' ' GLN . . . . . 0.471 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 56.2 tt0 -75.3 -56.24 4.92 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.634 179.367 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 148' ' ' ALA . . . . . 0.457 ' HB1' HH22 ' B' ' 154' ' ' ARG . . . -58.94 -53.96 52.47 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.687 -179.552 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.477 ' O ' ' O ' ' B' ' 150' ' ' ALA . 91.2 mt -47.37 -34.92 7.52 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-O 120.846 0.355 . . . . 0.0 110.179 -179.177 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 150' ' ' ALA . . . . . 0.477 ' O ' ' O ' ' B' ' 149' ' ' LEU . . . -58.74 -140.68 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.54 179.177 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 151' ' ' THR . . . . . 0.428 ' O ' ' O ' ' B' ' 150' ' ' ALA . 29.3 m 57.16 112.04 0.02 OUTLIER Pre-proline 0 CA--C 1.54 0.572 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.951 -179.517 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -47.47 -58.39 1.76 Allowed 'Trans proline' 0 N--CA 1.5 1.866 0 C-N-CA 122.396 2.064 . . . . 0.0 113.376 -179.068 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 88.6 p -45.18 -47.67 12.44 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 121.33 0.585 . . . . 0.0 110.858 -178.761 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 154' ' ' ARG . . . . . 0.457 HH22 ' HB1' ' B' ' 148' ' ' ALA . 83.6 mtp180 -73.52 -25.21 60.32 Favored 'General case' 0 C--N 1.319 -0.729 0 C-N-CA 120.338 -0.545 . . . . 0.0 110.291 179.802 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 155' ' ' LEU . . . . . 0.565 ' HB3' ' HB1' ' A' ' 20' ' ' ALA . 0.2 OUTLIER -66.42 -55.98 13.18 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 119.855 -0.738 . . . . 0.0 111.283 -178.337 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.66 -45.28 90.86 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.585 179.5 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 97.0 mt -62.59 -45.23 99.32 Favored 'Isoleucine or valine' 0 C--O 1.241 0.653 0 CA-C-O 121.496 0.665 . . . . 0.0 110.406 -179.207 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 5.8 tt -63.21 -41.24 99.12 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.685 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 83.3 m -59.14 -42.84 91.6 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.843 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 82.4 mm-40 -57.0 -45.24 83.16 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.966 179.516 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 161' ' ' LEU . . . . . 0.407 ' HA ' HD23 ' B' ' 161' ' ' LEU . 33.2 mt -66.26 -40.68 90.32 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.415 -0.514 . . . . 0.0 111.104 178.998 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 162' ' ' ARG . . . . . . . . . . . . . 73.7 ttp85 -60.24 -33.07 71.77 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.704 -179.71 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 17.5 t-20 -58.45 -40.52 82.83 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.383 -179.501 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . 168.58 168.92 31.35 Favored Glycine 0 CA--C 1.525 0.673 0 N-CA-C 110.984 -0.846 . . . . 0.0 110.984 179.827 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -65.83 144.42 77.22 Favored 'Trans proline' 0 C--N 1.308 -1.58 0 C-N-CA 122.836 2.357 . . . . 0.0 111.824 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 2.0 pp -176.23 147.39 0.83 Allowed Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.888 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -72.79 169.14 22.75 Favored 'Trans proline' 0 N--CA 1.496 1.674 0 C-N-CA 122.631 2.221 . . . . 0.0 112.129 179.058 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 168' ' ' VAL . . . . . 0.424 HG23 ' N ' ' B' ' 169' ' ' THR . 3.8 m -63.28 -38.27 81.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 121.446 0.641 . . . . 0.0 110.514 -179.69 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 169' ' ' THR . . . . . 0.424 ' N ' HG23 ' B' ' 168' ' ' VAL . 71.5 m -58.5 -44.81 89.56 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 114.597 -1.183 . . . . 0.0 110.35 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 53.6 t0 -69.03 -36.46 77.78 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.822 178.661 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 171' ' ' LEU . . . . . 0.667 ' C ' HD13 ' B' ' 171' ' ' LEU . 3.1 tm? -63.42 -44.17 95.39 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.001 -0.68 . . . . 0.0 110.308 -179.669 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 172' ' ' ALA . . . . . . . . . . . . . . . -61.0 -43.43 98.9 Favored 'General case' 0 CA--C 1.512 -0.494 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.541 179.738 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -59.93 -48.19 82.72 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 120.284 -0.566 . . . . 0.0 110.403 179.766 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -65.04 -52.77 53.99 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.026 -179.513 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 175' ' ' ILE . . . . . 0.657 ' O ' HG23 ' B' ' 175' ' ' ILE . 7.7 tt -176.17 87.42 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.456 -0.131 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.963 -179.425 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . -164.38 -57.41 0.02 OUTLIER Glycine 0 CA--C 1.522 0.491 0 N-CA-C 110.528 -1.029 . . . . 0.0 110.528 178.25 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 65.3 mtt 53.69 27.47 6.91 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.88 -0.328 . . . . 0.0 110.438 179.684 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 178' ' ' GLU . . . . . 0.507 ' HG2' ' H ' ' B' ' 181' ' ' ALA . 73.8 tt0 -164.62 87.73 0.47 Allowed 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 11.5 mt-30 -73.48 -23.09 60.02 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.822 -179.312 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 78.2 p -66.92 -41.2 87.47 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.86 -179.865 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 181' ' ' ALA . . . . . 0.507 ' H ' ' HG2' ' B' ' 178' ' ' GLU . . . -66.96 -33.29 75.24 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.27 179.739 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 77.9 t -69.69 -51.27 42.64 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.197 0 C-N-CA 120.721 -0.392 . . . . 0.0 110.781 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 92.1 p -59.28 -41.65 89.42 Favored 'General case' 0 C--N 1.332 -0.154 0 C-N-CA 120.675 -0.41 . . . . 0.0 110.566 -179.763 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 63.5 t-80 -66.26 -48.49 70.32 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-O 121.114 0.483 . . . . 0.0 110.757 -179.838 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 25.2 tp60 -63.81 -37.43 87.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.107 -179.835 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 186' ' ' LEU . . . . . 0.426 HD21 ' CD1' ' B' ' 206' ' ' TYR . 9.8 tp -63.22 -44.26 95.78 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.917 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 61.6 ttt85 -59.76 -44.34 93.91 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.614 -0.434 . . . . 0.0 110.23 -179.663 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 90.1 t -63.38 -54.28 34.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 C-N-CA 120.021 -0.672 . . . . 0.0 110.215 -179.669 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 85.6 mt -58.96 -36.09 74.23 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.161 0.505 . . . . 0.0 109.989 -179.111 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 70.1 ttt180 -60.21 -41.91 94.05 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.205 179.412 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 39.2 t-20 -60.37 -47.23 86.94 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 120.431 -0.508 . . . . 0.0 110.388 -179.291 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 192' ' ' LEU . . . . . . . . . . . . . 9.7 mt -65.06 -39.58 93.47 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.918 0.39 . . . . 0.0 110.565 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 193' ' ' GLY . . . . . 0.4 ' O ' ' CD2' ' B' ' 209' ' ' TYR . . . 104.41 28.77 5.63 Favored Glycine 0 CA--C 1.525 0.715 0 N-CA-C 110.855 -0.898 . . . . 0.0 110.855 -179.768 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 92.8 mt -88.86 -19.65 25.62 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.911 0.386 . . . . 0.0 110.758 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 24.6 m -136.05 158.94 39.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.157 -0.474 . . . . 0.0 109.99 179.705 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 196' ' ' VAL . . . . . 0.441 HG23 ' CD2' ' B' ' 209' ' ' TYR . 41.3 t -141.71 156.29 20.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.442 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 197' ' ' GLY . . . . . 0.414 ' N ' ' CG1' ' B' ' 196' ' ' VAL . . . -117.6 142.23 17.07 Favored Glycine 0 CA--C 1.525 0.703 0 N-CA-C 110.202 -1.159 . . . . 0.0 110.202 179.151 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 . . . . . 0 C--O 1.237 0.399 0 CA-C-O 120.664 0.269 . . . . 0.0 110.364 179.829 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 26.8 m . . . . . 0 N--CA 1.466 0.373 0 CA-C-O 120.783 0.325 . . . . 0.0 110.548 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 206' ' ' TYR . . . . . 0.426 ' CD1' HD21 ' B' ' 186' ' ' LEU . 65.7 m-85 -106.96 133.74 51.15 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.118 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 58.2 m -151.38 171.79 16.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.274 -179.742 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . 68.9 mt -64.53 150.2 47.19 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.487 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 209' ' ' TYR . . . . . 0.441 ' CD2' HG23 ' B' ' 196' ' ' VAL . 5.9 t80 -52.59 -47.44 66.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.394 -179.59 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 89.0 m-20 -140.19 167.4 22.22 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 121.165 0.507 . . . . 0.0 110.603 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 211' ' ' THR . . . . . 0.498 ' O ' ' HB3' ' B' ' 214' ' ' ALA . 40.9 p -78.17 -23.88 47.48 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.668 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 212' ' ' HIS . . . . . 0.551 ' CB ' ' CE1' ' A' ' 104' ' ' HIS . 65.1 m80 -41.4 -59.46 1.56 Allowed 'General case' 0 C--O 1.236 0.373 0 CA-C-O 121.25 0.547 . . . . 0.0 110.552 -179.892 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 8.7 m -55.87 -41.07 65.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.815 -0.63 . . . . 0.0 109.884 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 214' ' ' ALA . . . . . 0.498 ' HB3' ' O ' ' B' ' 211' ' ' THR . . . -55.52 -40.91 72.4 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.471 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 215' ' ' GLN . . . . . 0.439 ' O ' ' OE1' ' B' ' 219' ' ' GLU . 7.1 tp-100 -65.23 -42.78 93.04 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.217 179.733 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 216' ' ' LEU . . . . . 0.432 ' CD1' ' HB2' ' A' ' 101' ' ' ALA . 12.6 tp -59.25 -46.0 89.67 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.166 -0.614 . . . . 0.0 110.387 -178.784 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -64.98 -37.09 86.49 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.983 179.282 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 43.6 t0 -58.12 -42.42 85.72 Favored 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 120.496 -0.482 . . . . 0.0 110.49 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 219' ' ' GLU . . . . . 0.494 ' OE1' ' N ' ' B' ' 219' ' ' GLU . 2.4 mp0 -69.34 -51.67 34.74 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.505 179.732 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -58.33 -44.67 88.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.346 -179.713 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 221' ' ' ILE . . . . . 0.593 HD13 HG21 ' A' ' 23' ' ' VAL . 4.8 mm -62.67 -44.9 99.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.601 -179.265 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 74.5 t80 -64.55 -43.71 93.11 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.069 0.462 . . . . 0.0 110.299 179.779 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 223' ' ' HIS . . . . . 0.434 ' CD2' ' HB3' ' A' ' 93' ' ' HIS . 12.1 t-80 -59.65 -38.96 82.85 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.693 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 9.7 t -77.1 -44.94 28.68 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.991 0.424 . . . . 0.0 111.295 179.593 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -55.93 -31.16 62.67 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.438 -179.229 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 1.2 t60 . . . . . 0 C--N 1.328 -0.331 0 C-N-CA 120.373 -0.531 . . . . 0.0 110.118 -179.326 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 . . . . . 0 C--O 1.234 0.284 0 CA-C-O 121.117 0.485 . . . . 0.0 111.169 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 58.5 m -53.86 -34.48 59.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.455 -179.22 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 47.8 tt0 -68.03 -49.57 60.66 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.649 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.623 ' O ' HG23 ' A' ' 23' ' ' VAL . . . -54.74 -35.85 64.17 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 -179.934 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.32 -52.66 37.66 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.423 179.26 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.99 -49.2 77.63 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.797 0.332 . . . . 0.0 111.0 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -56.06 -50.95 69.54 Favored 'General case' 0 C--O 1.242 0.673 0 CA-C-O 121.279 0.561 . . . . 0.0 110.666 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.623 HG23 ' O ' ' A' ' 19' ' ' ALA . 90.6 t -60.49 -45.09 97.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.784 179.688 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.441 ' HB2' HD12 ' B' ' 155' ' ' LEU . . . -49.17 -46.17 45.04 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 121.014 -0.274 . . . . 0.0 110.391 179.216 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 36.0 t -59.56 -43.95 93.41 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.101 -0.499 . . . . 0.0 109.85 -179.861 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 20.2 m -65.68 -51.27 60.78 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.18 0.514 . . . . 0.0 110.812 179.486 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.544 ' CD1' HD13 ' B' ' 146' ' ' LEU . 4.1 mm? -62.26 -25.58 67.91 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.771 -179.896 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.493 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 54.7 tt0 -75.14 -53.38 8.95 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.849 179.499 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.47 -56.6 19.91 Favored 'General case' 0 CA--C 1.521 -0.171 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.838 -179.232 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.498 ' O ' ' O ' ' A' ' 31' ' ' ALA . 8.0 mp -45.11 -34.91 2.83 Favored 'General case' 0 CA--C 1.516 -0.364 0 C-N-CA 120.958 -0.297 . . . . 0.0 110.214 -179.237 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.498 ' O ' ' O ' ' A' ' 30' ' ' LEU . . . -57.31 -140.48 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.17 0.51 . . . . 0.0 110.357 179.291 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 37.7 m 59.66 110.1 0.02 OUTLIER Pre-proline 0 C--N 1.325 -0.487 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.308 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -51.15 -52.57 8.8 Favored 'Trans proline' 0 N--CA 1.496 1.641 0 C-N-CA 122.372 2.048 . . . . 0.0 113.155 -179.022 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 64.7 m -55.7 -45.48 77.85 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.902 -178.585 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 36.8 ttm180 -61.97 -44.44 96.75 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.733 -179.555 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.405 HD12 ' HB2' ' B' ' 143' ' ' ALA . 8.3 mt -62.08 -48.45 80.16 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.809 -0.356 . . . . 0.0 110.866 -179.666 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.468 ' O ' ' OG1' ' A' ' 40' ' ' THR . 49.8 ttp -53.95 -48.84 69.86 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-O 121.233 0.539 . . . . 0.0 110.204 179.612 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 97.9 mt -64.59 -42.72 95.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 121.342 0.591 . . . . 0.0 110.315 179.451 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 12.0 tp -62.24 -42.77 99.62 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.683 -179.273 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.468 ' OG1' ' O ' ' A' ' 37' ' ' MET . 21.3 p -59.52 -38.78 81.88 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.2 -0.455 . . . . 0.0 109.847 179.799 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.55 ' OE1' HD21 ' A' ' 52' ' ' LEU . 86.8 mt-30 -60.96 -46.47 90.6 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.536 -0.466 . . . . 0.0 110.005 178.798 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 92.8 mt -63.57 -38.78 92.45 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.755 179.268 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.42 ' O ' ' ND2' ' A' ' 44' ' ' ASN . 72.5 ttp85 -50.81 -42.82 58.6 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.418 -179.416 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.42 ' ND2' ' O ' ' A' ' 43' ' ' ARG . 12.8 m120 -135.36 48.81 2.22 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.375 179.582 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -175.23 78.77 0.08 OUTLIER Glycine 0 CA--C 1.529 0.959 0 N-CA-C 111.046 -0.822 . . . . 0.0 111.046 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -79.41 112.38 2.98 Favored 'Trans proline' 0 C--N 1.31 -1.461 0 C-N-CA 122.745 2.297 . . . . 0.0 111.504 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.575 HD12 ' O ' ' A' ' 47' ' ' LEU . 0.3 OUTLIER -160.75 156.01 21.16 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.622 -178.936 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -66.04 -178.66 1.12 Allowed 'Trans proline' 0 C--N 1.309 -1.527 0 C-N-CA 122.696 2.264 . . . . 0.0 111.89 179.034 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.571 HG23 ' N ' ' A' ' 50' ' ' THR . 3.5 m -68.06 -45.7 82.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 121.559 0.695 . . . . 0.0 111.383 -179.836 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.571 ' N ' HG23 ' A' ' 49' ' ' VAL . 58.3 p -55.85 -41.22 74.01 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.364 -0.834 . . . . 0.0 110.454 -179.516 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 66.9 m-20 -74.55 -40.24 61.82 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.507 179.457 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.74 HD23 ' O ' ' A' ' 52' ' ' LEU . 3.7 tt -60.98 -38.43 85.95 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.825 -179.658 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.585 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -69.63 -45.37 68.65 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.146 179.442 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 81.8 tt0 -52.76 -43.42 65.77 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.767 -0.373 . . . . 0.0 110.089 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -62.33 -42.95 99.8 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.538 179.838 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 96.6 mt -84.44 -67.12 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.454 179.588 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' GLY . . . . . 0.585 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 143.73 70.93 0.02 OUTLIER Glycine 0 CA--C 1.523 0.574 0 N-CA-C 111.141 -0.784 . . . . 0.0 111.141 179.672 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.426 ' C ' ' SD ' ' A' ' 58' ' ' MET . 2.7 tmm? 68.31 97.53 0.06 Allowed 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.76 -0.376 . . . . 0.0 110.762 179.647 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -173.85 24.9 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.078 0.466 . . . . 0.0 110.41 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -70.75 -23.58 62.45 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.044 0.45 . . . . 0.0 110.359 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 9.6 t -66.27 -44.37 83.8 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.584 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.1 -33.22 71.81 Favored 'General case' 0 C--O 1.24 0.605 0 CA-C-N 115.936 -0.575 . . . . 0.0 109.978 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 80.6 t -66.94 -49.99 68.79 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.083 179.713 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 50.5 m -53.04 -42.55 65.86 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 120.985 0.421 . . . . 0.0 110.163 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 83.4 t60 -58.3 -41.26 84.05 Favored 'General case' 0 C--O 1.242 0.697 0 CA-C-O 121.38 0.61 . . . . 0.0 109.63 178.708 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 55.1 tt0 -60.45 -38.86 85.51 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.859 -0.61 . . . . 0.0 109.993 179.249 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.644 ' HA ' HD23 ' A' ' 70' ' ' LEU . 24.0 mt -62.19 -42.35 99.2 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.391 179.861 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -55.26 -47.19 75.83 Favored 'General case' 0 C--O 1.24 0.575 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.874 179.481 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 90.7 t -68.31 -48.76 71.74 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.153 0 CA-C-O 121.172 0.51 . . . . 0.0 110.403 178.686 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.9 HD22 ' CG2' ' A' ' 76' ' ' VAL . 0.1 OUTLIER -49.06 -45.54 43.15 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 -179.277 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.632 ' N ' ' HG ' ' A' ' 70' ' ' LEU . 90.5 mtt-85 -62.35 -43.76 98.07 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.791 -178.508 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ASN . . . . . 0.43 ' C ' HD22 ' A' ' 73' ' ' LEU . 99.2 m-20 -65.34 -41.22 94.13 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.598 179.226 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.543 HD22 ' N ' ' A' ' 73' ' ' LEU . 4.0 mm? -95.61 -64.32 1.07 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.264 -179.135 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' GLY . . . . . 0.658 ' N ' ' O ' ' A' ' 70' ' ' LEU . . . 105.97 83.57 1.65 Allowed Glycine 0 CA--C 1.519 0.33 0 N-CA-C 110.54 -1.024 . . . . 0.0 110.54 -179.249 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 14.7 tp -125.64 -14.63 6.24 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.953 0.406 . . . . 0.0 110.549 -179.77 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.9 ' CG2' HD22 ' A' ' 70' ' ' LEU . 3.3 m -142.71 172.53 8.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.399 -179.763 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.449 HG23 ' HA ' ' A' ' 90' ' ' TYR . 24.6 t -137.62 150.93 25.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.577 178.924 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -128.58 146.92 17.26 Favored Glycine 0 CA--C 1.523 0.578 0 N-CA-C 110.446 -1.062 . . . . 0.0 110.446 179.3 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 . . . . . 0 N--CA 1.466 0.351 0 CA-C-O 120.774 0.321 . . . . 0.0 110.435 -179.852 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 64.8 t . . . . . 0 C--O 1.227 -0.128 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 94.3 m-85 -100.23 130.88 46.41 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.672 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 35.2 p -150.56 169.85 20.53 Favored 'General case' 0 C--O 1.223 -0.301 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 179.791 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 1.056 HD22 ' H ' ' A' ' 89' ' ' LEU . 0.6 OUTLIER -63.74 150.87 43.54 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.661 -179.626 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.466 ' N ' ' HA ' ' A' ' 76' ' ' VAL . 28.4 t80 -51.4 -48.9 62.47 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.244 -178.576 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.531 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 16.0 p-10 -153.05 -178.78 7.15 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.735 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 2.2 m -73.65 -3.26 27.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.422 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 8.5 t-160 -54.01 -74.85 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.062 0.458 . . . . 0.0 110.531 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 11.6 p -57.49 -33.81 45.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.324 -179.521 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.06 -47.67 84.9 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.633 179.694 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.44 ' O ' ' OE2' ' A' ' 100' ' ' GLU . 59.7 tt0 -63.87 -46.52 84.59 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.393 -179.749 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.448 ' CD1' ' HB2' ' B' ' 220' ' ' ALA . 13.8 tp -56.74 -45.7 81.83 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.221 -179.325 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 85.7 mt -63.32 -41.0 98.87 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.38 179.204 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -52.16 -45.04 64.91 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.41 -179.775 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.44 ' OE2' ' O ' ' A' ' 96' ' ' GLN . 0.9 OUTLIER -69.74 -50.46 43.27 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.666 -0.413 . . . . 0.0 110.903 179.782 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 101' ' ' ALA . . . . . 0.408 ' HB2' ' CD1' ' B' ' 216' ' ' LEU . . . -57.92 -53.55 56.91 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.923 -178.991 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.439 ' N ' ' CD1' ' A' ' 102' ' ' ILE . 1.2 mp -61.74 -44.93 99.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.617 -179.688 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 78.3 t80 -61.23 -50.61 72.39 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 120.492 -0.483 . . . . 0.0 110.804 -179.024 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' HIS . . . . . 0.41 ' CB ' ' CD2' ' B' ' 212' ' ' HIS . 68.7 m-70 -63.29 -36.96 85.4 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.615 -179.654 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 6.2 t -72.07 -46.14 58.04 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.93 179.742 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 81.7 tt0 -60.4 -24.43 65.14 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.187 -179.842 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 12.2 t-80 . . . . . 0 C--N 1.33 -0.246 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.645 179.588 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 . . . . . 0 C--O 1.236 0.365 0 CA-C-O 121.194 0.521 . . . . 0.0 111.179 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 42.0 m -52.34 -35.76 51.74 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.435 -179.324 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 40.9 tt0 -66.86 -48.93 67.3 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.625 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 138' ' ' ALA . . . . . 0.645 ' O ' HG23 ' B' ' 142' ' ' VAL . . . -55.35 -35.57 65.36 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 -179.825 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -67.19 -52.83 36.5 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.946 0.403 . . . . 0.0 110.433 179.33 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -58.13 -48.99 78.53 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.749 179.627 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 -56.4 -51.09 69.63 Favored 'General case' 0 C--O 1.241 0.608 0 CA-C-O 121.303 0.573 . . . . 0.0 110.779 -179.708 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 142' ' ' VAL . . . . . 0.645 HG23 ' O ' ' B' ' 138' ' ' ALA . 93.5 t -60.47 -45.0 97.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.688 179.615 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 143' ' ' ALA . . . . . 0.405 ' HB2' HD12 ' A' ' 36' ' ' LEU . . . -49.84 -46.02 50.91 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.467 179.536 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 14.9 t -58.84 -45.89 88.99 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.207 -0.451 . . . . 0.0 109.933 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 22.9 m -64.61 -51.22 63.8 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 121.121 0.486 . . . . 0.0 110.915 179.244 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 146' ' ' LEU . . . . . 0.544 HD13 ' CD1' ' A' ' 27' ' ' LEU . 4.1 mm? -61.63 -26.7 68.16 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.718 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 147' ' ' GLN . . . . . 0.493 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 55.3 tt0 -75.01 -54.31 7.4 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.847 179.611 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -58.06 -55.9 28.92 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.754 -179.203 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.518 ' O ' ' O ' ' B' ' 150' ' ' ALA . 8.6 mp -45.55 -35.17 3.74 Favored 'General case' 0 CA--C 1.513 -0.479 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.264 -179.228 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 150' ' ' ALA . . . . . 0.518 ' O ' ' O ' ' B' ' 149' ' ' LEU . . . -56.79 -140.7 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.114 0.483 . . . . 0.0 110.434 179.32 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 151' ' ' THR . . . . . . . . . . . . . 84.5 m 59.54 109.38 0.03 OUTLIER Pre-proline 0 C--N 1.324 -0.536 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.336 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -50.46 -54.54 5.28 Favored 'Trans proline' 0 N--CA 1.497 1.689 0 C-N-CA 122.407 2.071 . . . . 0.0 113.066 -179.238 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 52.4 m -53.21 -45.7 68.74 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.953 -178.692 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 37.7 ttm180 -62.54 -44.28 96.74 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.749 -179.459 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 155' ' ' LEU . . . . . 0.441 HD12 ' HB2' ' A' ' 24' ' ' ALA . 8.6 mt -62.37 -46.72 87.38 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.831 -0.347 . . . . 0.0 110.918 -179.604 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 156' ' ' MET . . . . . 0.484 ' O ' ' OG1' ' B' ' 159' ' ' THR . 46.6 ttp -55.45 -49.07 73.43 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.298 0.571 . . . . 0.0 110.206 179.623 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 97.0 mt -64.62 -42.84 96.23 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 0 CA-C-O 121.276 0.56 . . . . 0.0 110.258 179.404 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 7.6 tp -62.1 -41.61 98.39 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.7 -179.257 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 159' ' ' THR . . . . . 0.484 ' OG1' ' O ' ' B' ' 156' ' ' MET . 16.9 p -60.67 -38.13 83.88 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.459 . . . . 0.0 109.956 179.85 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 87.1 mt-30 -61.75 -46.27 90.33 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.067 178.837 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 161' ' ' LEU . . . . . 0.414 HD23 ' HA ' ' B' ' 161' ' ' LEU . 90.4 mt -63.59 -38.72 92.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.713 179.267 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 162' ' ' ARG . . . . . 0.471 ' O ' ' ND2' ' B' ' 163' ' ' ASN . 73.7 ttp85 -50.23 -41.0 49.22 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.505 -179.425 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 163' ' ' ASN . . . . . 0.471 ' ND2' ' O ' ' B' ' 162' ' ' ARG . 16.0 m120 -138.4 49.83 1.9 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.376 179.736 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . -175.87 76.89 0.08 OUTLIER Glycine 0 CA--C 1.528 0.887 0 N-CA-C 111.119 -0.792 . . . . 0.0 111.119 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -77.43 114.34 3.71 Favored 'Trans proline' 0 N--CA 1.494 1.535 0 C-N-CA 122.8 2.333 . . . . 0.0 111.593 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 166' ' ' LEU . . . . . 0.492 ' O ' HD12 ' B' ' 166' ' ' LEU . 0.3 OUTLIER -160.36 157.37 24.32 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.656 -178.926 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -65.17 176.69 2.99 Favored 'Trans proline' 0 C--N 1.308 -1.595 0 C-N-CA 122.817 2.345 . . . . 0.0 111.753 179.006 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 168' ' ' VAL . . . . . 0.542 HG23 ' N ' ' B' ' 169' ' ' THR . 3.8 m -63.22 -43.47 98.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 121.522 0.677 . . . . 0.0 111.306 -179.718 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 169' ' ' THR . . . . . 0.542 ' N ' HG23 ' B' ' 168' ' ' VAL . 52.3 p -57.21 -66.65 0.42 Allowed 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.639 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 92.9 m-20 -50.02 -38.69 38.7 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 -179.499 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 171' ' ' LEU . . . . . 0.711 HD23 ' O ' ' B' ' 171' ' ' LEU . 5.0 tt -59.43 -41.91 90.64 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.59 -0.444 . . . . 0.0 109.999 179.531 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 172' ' ' ALA . . . . . 0.598 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -67.66 -43.19 80.84 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.55 -0.296 . . . . 0.0 110.306 179.386 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 85.3 tt0 -53.33 -42.36 66.65 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.054 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -62.83 -40.87 98.76 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.4 179.781 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 96.5 mt -87.87 -68.31 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.314 179.588 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 176' ' ' GLY . . . . . 0.598 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 144.75 72.75 0.02 OUTLIER Glycine 0 CA--C 1.524 0.62 0 N-CA-C 111.078 -0.809 . . . . 0.0 111.078 179.531 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 3.1 tmm? 67.26 97.95 0.05 Allowed 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.673 -0.411 . . . . 0.0 110.591 179.593 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -173.07 22.46 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.204 0.526 . . . . 0.0 110.431 179.684 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -69.15 -24.75 64.12 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.037 0.446 . . . . 0.0 110.384 -179.876 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 12.1 t -65.71 -43.65 88.47 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 121.182 0.515 . . . . 0.0 110.503 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -60.85 -32.41 71.82 Favored 'General case' 0 C--O 1.239 0.53 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.089 179.575 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 182' ' ' VAL . . . . . 0.407 ' O ' ' HG ' ' B' ' 186' ' ' LEU . 94.5 t -67.21 -50.56 62.05 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.375 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.102 179.544 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 70.0 m -53.02 -41.94 65.18 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 121.029 0.442 . . . . 0.0 110.129 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -58.59 -42.22 87.58 Favored 'General case' 0 C--O 1.242 0.676 0 CA-C-O 121.406 0.622 . . . . 0.0 109.788 178.634 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 58.4 tt0 -60.09 -38.67 83.63 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.087 179.282 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 186' ' ' LEU . . . . . 0.69 ' HA ' HD23 ' B' ' 189' ' ' LEU . 22.1 mt -62.24 -42.71 99.56 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-O 120.922 0.392 . . . . 0.0 110.52 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -54.95 -47.19 74.82 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.681 179.439 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 97.0 t -67.79 -48.85 74.11 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.106 0 C-N-CA 120.427 -0.509 . . . . 0.0 110.255 178.664 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 189' ' ' LEU . . . . . 0.901 HD22 ' CG2' ' B' ' 195' ' ' VAL . 0.1 OUTLIER -49.58 -45.4 47.76 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 -179.146 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 190' ' ' ARG . . . . . 0.63 ' N ' ' HG ' ' B' ' 189' ' ' LEU . 90.3 mtt-85 -61.81 -43.21 99.31 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.727 -0.67 . . . . 0.0 109.716 -178.485 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 191' ' ' ASN . . . . . 0.443 ' C ' HD22 ' B' ' 192' ' ' LEU . 99.3 m-20 -66.07 -41.07 91.26 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.937 179.153 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 192' ' ' LEU . . . . . 0.543 ' N ' HD22 ' B' ' 192' ' ' LEU . 4.0 mm? -95.8 -61.63 1.42 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.306 -178.862 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 193' ' ' GLY . . . . . 0.686 ' N ' ' O ' ' B' ' 189' ' ' LEU . . . 103.05 82.47 1.63 Allowed Glycine 0 CA--C 1.52 0.349 0 N-CA-C 110.462 -1.055 . . . . 0.0 110.462 -179.42 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 15.6 tp -124.68 -15.0 6.66 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-O 120.951 0.405 . . . . 0.0 110.743 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 195' ' ' VAL . . . . . 0.901 ' CG2' HD22 ' B' ' 189' ' ' LEU . 3.0 m -142.2 171.91 9.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.376 -179.724 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 196' ' ' VAL . . . . . 0.448 HG23 ' HA ' ' B' ' 209' ' ' TYR . 24.7 t -137.76 152.17 26.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.473 178.745 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 197' ' ' GLY . . . . . . . . . . . . . . . -130.68 148.36 18.7 Favored Glycine 0 CA--C 1.522 0.494 0 N-CA-C 110.54 -1.024 . . . . 0.0 110.54 179.23 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 89.1 m-20 . . . . . 0 C--O 1.236 0.355 0 CA-C-O 120.803 0.335 . . . . 0.0 110.621 -179.784 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 71.2 t . . . . . 0 C--O 1.226 -0.154 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -101.27 130.76 47.46 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.675 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 18.0 p -151.13 170.3 19.77 Favored 'General case' 0 C--O 1.223 -0.339 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 208' ' ' LEU . . . . . 1.044 HD22 ' H ' ' B' ' 208' ' ' LEU . 0.5 OUTLIER -63.41 152.07 39.23 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.653 -179.583 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 209' ' ' TYR . . . . . 0.478 ' N ' ' HA ' ' B' ' 195' ' ' VAL . 29.0 t80 -53.96 -48.38 70.37 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.234 -178.578 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 210' ' ' ASP . . . . . 0.531 ' N ' ' OD1' ' B' ' 210' ' ' ASP . 16.3 p-10 -151.56 179.8 8.06 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.74 179.806 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 2.5 m -74.19 -1.81 22.01 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.473 -179.842 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 212' ' ' HIS . . . . . 0.41 ' CD2' ' CB ' ' A' ' 104' ' ' HIS . 9.0 t-160 -56.04 -73.63 0.06 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.992 0.425 . . . . 0.0 110.46 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 9.6 p -57.54 -33.02 43.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.319 -179.609 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 214' ' ' ALA . . . . . . . . . . . . . . . -61.34 -47.96 83.52 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.637 179.699 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 215' ' ' GLN . . . . . 0.443 ' O ' ' OE1' ' B' ' 219' ' ' GLU . 59.4 tt0 -63.69 -46.28 86.23 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.338 -179.698 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 216' ' ' LEU . . . . . 0.408 ' CD1' ' HB2' ' A' ' 101' ' ' ALA . 14.5 tp -56.58 -46.11 80.98 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.217 -179.262 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 86.0 mt -63.53 -39.63 94.92 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.281 179.284 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -52.79 -45.44 67.17 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.4 -179.772 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 219' ' ' GLU . . . . . 0.443 ' OE1' ' O ' ' B' ' 215' ' ' GLN . 1.1 mp0 -70.44 -48.53 55.49 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.98 179.761 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 220' ' ' ALA . . . . . 0.448 ' HB2' ' CD1' ' A' ' 97' ' ' LEU . . . -59.21 -53.4 58.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.046 -179.003 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 221' ' ' ILE . . . . . 0.437 ' N ' ' CD1' ' B' ' 221' ' ' ILE . 1.2 mp -62.27 -44.82 99.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.663 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 75.9 t80 -61.07 -49.9 75.46 Favored 'General case' 0 C--N 1.32 -0.691 0 C-N-CA 120.475 -0.49 . . . . 0.0 110.747 -179.088 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 223' ' ' HIS . . . . . . . . . . . . . 56.4 m-70 -64.06 -37.18 86.49 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.727 -179.74 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 9.1 t -71.69 -45.99 60.16 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.915 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -60.71 -23.63 65.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.369 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 9.8 t-80 . . . . . 0 C--N 1.331 -0.22 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.615 179.511 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 . . . . . 0 N--CA 1.465 0.314 0 CA-C-O 121.12 0.486 . . . . 0.0 110.768 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 46.0 m -59.18 -33.35 70.84 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.228 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -67.56 -49.15 64.57 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.496 179.69 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -57.95 -36.07 72.02 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.927 -0.309 . . . . 0.0 110.289 -179.826 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.71 -53.52 26.9 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 120.884 0.373 . . . . 0.0 110.492 179.637 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.08 -42.07 99.55 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.912 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 16.5 mm100 -61.32 -52.9 62.75 Favored 'General case' 0 C--O 1.239 0.509 0 CA-C-O 121.304 0.573 . . . . 0.0 110.644 -179.603 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 74.4 t -62.19 -47.09 94.75 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.854 179.589 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -53.13 -42.81 66.4 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 120.809 -0.356 . . . . 0.0 110.252 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 50.0 m -59.55 -43.39 93.56 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.332 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 17.6 m -64.42 -51.98 60.47 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 120.449 -0.5 . . . . 0.0 110.725 179.769 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.445 ' N ' ' CD1' ' A' ' 27' ' ' LEU . 7.9 mp -66.16 -20.02 66.01 Favored 'General case' 0 CA--C 1.513 -0.457 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.615 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.445 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 54.1 tt0 -74.01 -63.44 1.22 Allowed 'General case' 0 C--N 1.32 -0.687 0 O-C-N 123.418 0.449 . . . . 0.0 110.842 179.697 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -57.47 -51.96 67.32 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.939 -179.191 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.437 ' O ' ' C ' ' A' ' 31' ' ' ALA . 4.1 mm? -54.52 -39.15 67.35 Favored 'General case' 0 CA--C 1.508 -0.645 0 C-N-CA 120.876 -0.329 . . . . 0.0 110.279 -178.851 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.555 ' O ' ' C ' ' A' ' 32' ' ' THR . . . -37.67 -69.31 0.12 Allowed 'General case' 0 CA--C 1.511 -0.549 0 O-C-N 123.531 0.519 . . . . 0.0 110.062 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.555 ' C ' ' O ' ' A' ' 31' ' ' ALA . 15.9 m -5.57 111.57 0.03 OUTLIER Pre-proline 0 CA--C 1.54 0.595 0 O-C-N 124.851 1.344 . . . . 0.0 111.124 -179.334 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_exo -45.75 -42.9 19.39 Favored 'Trans proline' 0 C--N 1.309 -1.511 0 C-N-CA 122.246 1.964 . . . . 0.0 112.652 -178.008 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 67.5 m -57.66 -46.69 83.9 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.609 -179.481 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -67.06 -36.85 82.93 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.053 0.454 . . . . 0.0 110.179 179.622 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.465 HD13 ' O ' ' A' ' 36' ' ' LEU . 0.2 OUTLIER -59.2 -52.85 63.91 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 120.097 -0.641 . . . . 0.0 110.725 -178.047 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 64.2 ttp -62.74 -44.48 96.1 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.938 179.732 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 89.3 mt -60.26 -44.56 95.89 Favored 'Isoleucine or valine' 0 C--O 1.242 0.678 0 CA-C-O 121.584 0.707 . . . . 0.0 110.685 -178.964 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -63.84 -39.0 93.18 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.632 179.639 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 14.9 m -59.02 -39.32 81.57 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.797 179.717 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -62.31 -44.77 95.73 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.235 179.627 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.449 ' O ' ' N ' ' A' ' 45' ' ' GLY . 23.6 mt -62.51 -43.12 99.58 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 120.504 -0.478 . . . . 0.0 111.293 179.686 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.504 HH21 ' CG ' ' A' ' 99' ' ' ASP . 79.3 ttt-85 -40.14 -31.12 0.11 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.685 -179.703 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 78.3 m-20 -60.07 -42.3 94.25 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.267 -179.497 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.449 ' N ' ' O ' ' A' ' 42' ' ' LEU . . . 126.29 -116.08 2.46 Favored Glycine 0 CA--C 1.535 1.339 0 N-CA-C 111.384 -0.686 . . . . 0.0 111.384 179.204 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -73.95 128.83 12.7 Favored 'Trans proline' 0 N--CA 1.495 1.609 0 C-N-CA 122.271 1.981 . . . . 0.0 112.434 -179.153 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -176.33 86.46 0.27 Allowed Pre-proline 0 C--N 1.327 -0.407 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.445 179.443 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -49.35 171.12 0.08 OUTLIER 'Trans proline' 0 C--N 1.306 -1.688 0 C-N-CA 122.742 2.294 . . . . 0.0 112.281 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 70.4 t -55.4 -44.28 75.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.25 -179.531 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 19.0 m -61.75 -44.32 97.12 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.284 179.207 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 66.2 t0 -63.94 -40.35 96.25 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-O 121.383 0.611 . . . . 0.0 110.296 179.692 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.616 HD23 ' O ' ' A' ' 52' ' ' LEU . 5.1 tt -61.31 -44.19 97.62 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.778 -0.646 . . . . 0.0 109.831 -179.741 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.579 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -59.21 -43.73 92.27 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 179.543 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 84.7 tt0 -54.56 -47.05 73.72 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.068 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -57.89 -49.98 74.87 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.546 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.455 HD12 ' CD2' ' A' ' 52' ' ' LEU . 96.8 mt -85.36 -73.76 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.522 -0.126 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.238 179.688 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' GLY . . . . . 0.579 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 131.74 77.37 0.14 Allowed Glycine 0 N--CA 1.461 0.331 0 N-CA-C 111.472 -0.651 . . . . 0.0 111.472 179.218 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.473 ' CB ' ' O ' ' A' ' 57' ' ' GLY . 23.2 ttm 80.93 99.26 0.06 Allowed 'General case' 0 C--O 1.234 0.239 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.955 178.867 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 179.32 22.18 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.165 179.776 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 55.3 mt-30 -56.92 -27.82 61.34 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 120.825 0.345 . . . . 0.0 111.135 -179.145 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 45.7 m -70.04 -45.83 66.33 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 120.931 0.396 . . . . 0.0 111.212 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.26 -29.3 70.65 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.116 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 70.0 t -72.66 -52.21 24.25 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.246 0 C-N-CA 120.546 -0.461 . . . . 0.0 110.596 179.751 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 11.1 t -55.2 -43.37 74.34 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.303 -0.559 . . . . 0.0 110.558 -179.383 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 60.0 t-80 -69.62 -49.45 53.81 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.364 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 11.1 tp-100 -58.98 -45.35 90.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.58 -179.231 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.401 ' O ' ' CG ' ' A' ' 71' ' ' ARG . 3.1 mm? -63.63 -40.11 96.06 Favored 'General case' 0 CA--C 1.502 -0.878 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.479 -179.885 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 72.1 ttt180 -58.24 -43.63 87.89 Favored 'General case' 0 C--N 1.303 -1.414 0 C-N-CA 120.016 -0.673 . . . . 0.0 110.099 179.364 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 91.9 t -67.84 -53.83 27.52 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.385 179.692 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.599 ' O ' ' N ' ' A' ' 74' ' ' GLY . 94.2 mt -57.93 -38.38 75.83 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-N 116.151 -0.477 . . . . 0.0 109.807 -179.507 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.401 ' CG ' ' O ' ' A' ' 67' ' ' LEU . 11.0 mmm180 -59.93 -43.42 94.95 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.139 179.658 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ASN . . . . . 0.42 ' CB ' HD23 ' A' ' 73' ' ' LEU . 88.1 m-20 -64.88 -43.44 92.92 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 120.466 -0.494 . . . . 0.0 110.314 179.78 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.42 HD23 ' CB ' ' A' ' 72' ' ' ASN . 0.4 OUTLIER -153.93 73.02 0.92 Allowed 'General case' 0 C--N 1.334 -0.067 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.755 179.28 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 74' ' ' GLY . . . . . 0.599 ' N ' ' O ' ' A' ' 70' ' ' LEU . . . -147.2 1.05 0.73 Allowed Glycine 0 N--CA 1.464 0.564 0 N-CA-C 110.882 -0.887 . . . . 0.0 110.882 -179.738 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.577 HD22 ' N ' ' A' ' 75' ' ' LEU . 3.8 mm? 55.43 61.25 2.95 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.849 0.357 . . . . 0.0 110.994 179.523 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 34.0 m -132.52 156.25 42.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.193 179.217 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.727 HG12 ' N ' ' A' ' 78' ' ' GLY . 60.3 t -131.83 174.04 13.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.239 -179.651 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' GLY . . . . . 0.727 ' N ' HG12 ' A' ' 77' ' ' VAL . . . -165.29 159.21 32.32 Favored Glycine 0 CA--C 1.526 0.739 0 N-CA-C 110.519 -1.032 . . . . 0.0 110.519 179.07 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 . . . . . 0 N--CA 1.47 0.544 0 CA-C-O 120.753 0.311 . . . . 0.0 110.697 -179.89 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 72.8 t . . . . . 0 CA--C 1.521 -0.166 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 99.7 m-85 -106.35 130.44 54.18 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.621 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 66.9 m -150.5 171.04 17.7 Favored 'General case' 0 C--N 1.341 0.2 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 49.4 mt -79.24 146.82 32.82 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.56 -179.707 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 6.0 t80 -56.08 -48.06 76.8 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.654 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 75.6 m-20 -125.47 176.39 6.85 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 116.433 -0.348 . . . . 0.0 110.291 -179.768 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 22.3 p -99.8 -1.84 36.57 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.323 -179.688 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' HIS . . . . . 0.572 ' CE1' ' CD2' ' B' ' 223' ' ' HIS . 60.8 m80 -53.61 -55.33 26.77 Favored 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 120.855 -0.338 . . . . 0.0 110.376 -179.817 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.491 ' HA ' HD21 ' A' ' 97' ' ' LEU . 61.4 t -44.5 -39.01 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.047 0.451 . . . . 0.0 110.322 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -71.68 -36.5 70.64 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.939 179.555 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 96.2 mm-40 -64.3 -53.28 51.44 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.188 0.518 . . . . 0.0 111.285 -178.719 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.491 HD21 ' HA ' ' A' ' 94' ' ' VAL . 3.2 pp -67.94 -39.93 83.39 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.557 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.447 ' N ' HD12 ' A' ' 97' ' ' LEU . 6.4 tt -65.36 -41.37 93.88 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.226 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 99' ' ' ASP . . . . . 0.504 ' CG ' HH21 ' A' ' 43' ' ' ARG . 78.4 m-20 -61.86 -38.35 87.93 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.845 -179.646 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.424 ' OE2' ' OE2' ' B' ' 219' ' ' GLU . 97.9 mt-10 -71.67 -44.68 63.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.847 179.308 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -63.06 -49.83 72.99 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.57 -179.637 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.425 HD13 ' HG ' ' A' ' 98' ' ' LEU . 1.2 mp -63.77 -43.83 98.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.875 178.976 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 89.2 t80 -60.02 -47.82 84.26 Favored 'General case' 0 C--N 1.313 -0.991 0 C-N-CA 120.626 -0.43 . . . . 0.0 110.831 -179.26 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' HIS . . . . . 0.519 ' CD2' ' CE1' ' B' ' 212' ' ' HIS . 11.7 t-160 -66.65 -35.98 81.47 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.124 179.765 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 4.4 t -73.3 -49.61 26.64 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.002 0.43 . . . . 0.0 111.487 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -67.28 -21.18 65.71 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.626 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 19.8 t60 . . . . . 0 N--CA 1.452 -0.326 0 C-N-CA 120.694 -0.403 . . . . 0.0 110.426 -179.277 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 92.8 m-20 . . . . . 0 C--O 1.235 0.312 0 CA-C-O 121.222 0.534 . . . . 0.0 110.722 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 65.0 m -59.85 -33.04 71.26 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.323 179.803 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 -67.88 -49.52 61.55 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.467 179.741 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 138' ' ' ALA . . . . . 0.456 ' O ' HG23 ' B' ' 142' ' ' VAL . . . -57.49 -35.63 70.45 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.89 -0.324 . . . . 0.0 110.287 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -67.54 -53.35 29.14 Favored 'General case' 0 CA--C 1.528 0.133 0 C-N-CA 120.759 -0.377 . . . . 0.0 110.534 179.615 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -63.06 -41.31 99.42 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.872 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 19.6 mm100 -62.08 -52.86 62.21 Favored 'General case' 0 C--O 1.239 0.542 0 CA-C-O 121.068 0.461 . . . . 0.0 110.603 -179.571 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 142' ' ' VAL . . . . . 0.456 HG23 ' O ' ' B' ' 138' ' ' ALA . 84.2 t -62.28 -46.96 95.22 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 179.598 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -53.17 -43.11 66.83 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.193 179.682 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 69.3 m -59.17 -44.45 92.16 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.426 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 21.6 m -64.52 -51.5 62.6 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.715 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 146' ' ' LEU . . . . . 0.418 ' N ' ' CD1' ' B' ' 146' ' ' LEU . 8.3 mp -66.09 -20.16 66.07 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.681 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 147' ' ' GLN . . . . . 0.471 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 58.3 tt0 -74.62 -62.93 1.36 Allowed 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.889 179.818 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -57.91 -52.55 65.01 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.138 -179.12 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.427 ' O ' ' C ' ' B' ' 150' ' ' ALA . 4.2 mm? -53.78 -37.57 63.58 Favored 'General case' 0 CA--C 1.508 -0.665 0 C-N-CA 120.794 -0.362 . . . . 0.0 110.194 -178.884 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 150' ' ' ALA . . . . . 0.552 ' O ' ' C ' ' B' ' 151' ' ' THR . . . -39.31 -70.16 0.11 Allowed 'General case' 0 CA--C 1.511 -0.543 0 O-C-N 123.483 0.49 . . . . 0.0 110.136 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 151' ' ' THR . . . . . 0.552 ' C ' ' O ' ' B' ' 150' ' ' ALA . 11.2 m -5.19 111.43 0.03 OUTLIER Pre-proline 0 N--CA 1.471 0.624 0 O-C-N 124.827 1.329 . . . . 0.0 111.07 -179.301 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -45.55 -42.43 18.46 Favored 'Trans proline' 0 C--N 1.307 -1.634 0 C-N-CA 122.26 1.973 . . . . 0.0 112.686 -177.806 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 73.0 m -58.02 -45.89 86.18 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.53 -179.6 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 92.9 mtt180 -68.17 -37.08 80.6 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.191 0.519 . . . . 0.0 110.251 179.55 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 155' ' ' LEU . . . . . 0.473 ' O ' HD13 ' B' ' 155' ' ' LEU . 0.2 OUTLIER -59.86 -52.88 63.55 Favored 'General case' 0 C--N 1.32 -0.703 0 C-N-CA 120.032 -0.667 . . . . 0.0 111.009 -178.155 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 65.5 ttp -62.83 -44.13 96.96 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.706 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 80.3 mt -60.38 -44.58 96.34 Favored 'Isoleucine or valine' 0 C--O 1.241 0.636 0 CA-C-O 121.478 0.656 . . . . 0.0 110.465 -179.144 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -63.38 -39.81 95.53 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.662 179.335 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 25.0 m -57.94 -39.89 79.16 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.725 179.594 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 98.9 mm-40 -61.71 -45.1 95.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.236 179.721 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 161' ' ' LEU . . . . . 0.431 ' O ' ' N ' ' B' ' 164' ' ' GLY . 21.8 mt -62.8 -43.13 99.62 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 120.442 -0.503 . . . . 0.0 111.256 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 162' ' ' ARG . . . . . 0.501 HH21 ' CG ' ' B' ' 218' ' ' ASP . 78.9 ttt-85 -40.46 -30.15 0.1 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.736 -179.834 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 82.3 m-20 -60.48 -42.66 96.71 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.293 -179.333 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 164' ' ' GLY . . . . . 0.431 ' N ' ' O ' ' B' ' 161' ' ' LEU . . . 127.57 -114.89 2.0 Favored Glycine 0 CA--C 1.538 1.469 0 N-CA-C 111.191 -0.764 . . . . 0.0 111.191 179.252 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -75.8 129.09 11.34 Favored 'Trans proline' 0 N--CA 1.494 1.552 0 C-N-CA 122.4 2.067 . . . . 0.0 112.331 -179.537 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -175.91 84.14 0.29 Allowed Pre-proline 0 C--N 1.327 -0.394 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.242 179.457 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 55.1 Cg_exo -48.1 171.79 0.05 OUTLIER 'Trans proline' 0 C--N 1.305 -1.72 0 C-N-CA 122.756 2.304 . . . . 0.0 112.3 -179.847 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . 72.3 t -55.26 -44.96 77.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.317 -179.438 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 169' ' ' THR . . . . . . . . . . . . . 13.2 m -62.36 -44.46 96.42 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.367 179.18 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 64.3 t0 -63.3 -39.92 95.9 Favored 'General case' 0 C--O 1.24 0.553 0 CA-C-O 121.433 0.635 . . . . 0.0 110.162 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 171' ' ' LEU . . . . . 0.61 HD23 ' O ' ' B' ' 171' ' ' LEU . 4.5 tt -62.12 -43.91 97.81 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.81 -179.665 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 172' ' ' ALA . . . . . 0.577 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -59.42 -43.94 92.98 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 179.717 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 82.2 tt0 -54.46 -46.78 73.38 Favored 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 120.615 -0.434 . . . . 0.0 109.996 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -58.7 -50.76 72.7 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 120.683 -0.407 . . . . 0.0 110.693 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 93.8 mt -83.97 -73.53 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.102 179.617 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 176' ' ' GLY . . . . . 0.577 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 131.34 77.9 0.16 Allowed Glycine 0 C--N 1.332 0.309 0 N-CA-C 111.567 -0.613 . . . . 0.0 111.567 179.429 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 177' ' ' MET . . . . . 0.456 ' CB ' ' O ' ' B' ' 176' ' ' GLY . 23.9 ttm 79.94 99.39 0.06 Allowed 'General case' 0 C--O 1.233 0.229 0 C-N-CA 120.801 -0.36 . . . . 0.0 111.01 178.793 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 178' ' ' GLU . . . . . 0.424 ' OE1' ' O ' ' B' ' 177' ' ' MET . 1.3 tp10 179.45 22.97 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.18 179.632 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 51.2 mt-30 -57.82 -27.12 62.88 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 120.897 0.38 . . . . 0.0 111.027 -179.124 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 69.6 m -70.41 -45.99 64.84 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.159 179.844 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -63.47 -29.28 70.59 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.119 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 84.4 t -72.51 -52.41 23.67 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.305 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.45 179.669 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 9.5 t -55.12 -43.13 73.8 Favored 'General case' 0 C--N 1.32 -0.701 0 C-N-CA 120.282 -0.567 . . . . 0.0 110.614 -179.52 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 -69.98 -49.63 49.78 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.329 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 10.7 tp-100 -59.02 -45.34 90.96 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.016 0.436 . . . . 0.0 110.652 -179.195 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -63.57 -40.36 96.77 Favored 'General case' 0 CA--C 1.502 -0.893 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.32 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 72.9 ttt180 -58.43 -43.75 88.86 Favored 'General case' 0 C--N 1.304 -1.394 0 C-N-CA 120.08 -0.648 . . . . 0.0 110.242 179.41 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 84.0 t -67.49 -53.5 31.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.169 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.102 179.798 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 189' ' ' LEU . . . . . 0.589 ' O ' ' N ' ' B' ' 193' ' ' GLY . 94.6 mt -57.73 -38.45 75.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.27 0.557 . . . . 0.0 109.741 -179.513 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 8.9 mmm180 -59.72 -44.13 93.87 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.302 179.72 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 191' ' ' ASN . . . . . 0.443 ' CB ' HD23 ' B' ' 192' ' ' LEU . 87.8 m-20 -64.42 -42.86 95.81 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.424 -0.51 . . . . 0.0 110.261 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 192' ' ' LEU . . . . . 0.443 HD23 ' CB ' ' B' ' 191' ' ' ASN . 0.4 OUTLIER -154.78 74.56 0.94 Allowed 'General case' 0 C--O 1.23 0.065 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.692 179.292 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 193' ' ' GLY . . . . . 0.589 ' N ' ' O ' ' B' ' 189' ' ' LEU . . . -148.38 0.73 0.59 Allowed Glycine 0 N--CA 1.463 0.471 0 N-CA-C 110.921 -0.872 . . . . 0.0 110.921 -179.648 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 194' ' ' LEU . . . . . 0.602 HD22 ' N ' ' B' ' 194' ' ' LEU . 3.7 mm? 56.28 60.44 3.16 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.814 0.34 . . . . 0.0 110.869 179.585 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 34.4 m -131.82 154.72 40.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.205 179.232 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 196' ' ' VAL . . . . . 0.468 HG12 ' N ' ' B' ' 197' ' ' GLY . 54.0 t -136.61 155.9 34.61 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.28 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.541 -179.379 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 197' ' ' GLY . . . . . 0.468 ' N ' HG12 ' B' ' 196' ' ' VAL . . . -145.67 158.74 27.76 Favored Glycine 0 CA--C 1.521 0.426 0 N-CA-C 110.341 -1.103 . . . . 0.0 110.341 179.718 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 . . . . . 0 N--CA 1.469 0.505 0 CA-C-O 120.941 0.4 . . . . 0.0 110.677 -179.807 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 83.2 t . . . . . 0 C--O 1.225 -0.197 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 98.9 m-85 -105.45 130.66 53.48 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.557 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 69.9 m -150.82 171.52 17.09 Favored 'General case' 0 C--O 1.227 -0.12 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . 41.1 mt -79.04 147.44 32.84 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.535 -179.643 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 209' ' ' TYR . . . . . 0.435 ' CD2' ' CG2' ' B' ' 196' ' ' VAL . 5.9 t80 -55.66 -48.48 74.96 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.715 -0.394 . . . . 0.0 110.348 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 80.4 m-20 -124.74 -178.54 4.18 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 -179.716 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 66.6 p -104.02 -2.68 25.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.362 -179.771 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 212' ' ' HIS . . . . . 0.519 ' CE1' ' CD2' ' A' ' 104' ' ' HIS . 65.5 m80 -52.62 -54.98 25.73 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.332 -179.769 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 213' ' ' VAL . . . . . 0.509 ' HA ' HD21 ' B' ' 216' ' ' LEU . 10.6 t -44.67 -40.01 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 121.039 0.447 . . . . 0.0 110.282 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 214' ' ' ALA . . . . . . . . . . . . . . . -71.61 -36.75 70.89 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.906 179.547 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 97.5 mm-40 -64.24 -53.76 43.99 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.227 0.537 . . . . 0.0 111.223 -178.664 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 216' ' ' LEU . . . . . 0.509 HD21 ' HA ' ' B' ' 213' ' ' VAL . 3.1 pp -67.29 -40.08 86.07 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.621 -179.846 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 217' ' ' LEU . . . . . 0.453 ' HG ' HD13 ' B' ' 221' ' ' ILE . 6.3 tt -65.05 -42.33 94.35 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.467 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 218' ' ' ASP . . . . . 0.501 ' CG ' HH21 ' B' ' 162' ' ' ARG . 93.5 m-20 -61.13 -37.9 84.47 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.027 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 219' ' ' GLU . . . . . 0.424 ' OE2' ' OE2' ' A' ' 100' ' ' GLU . 97.2 mt-10 -71.79 -42.59 66.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.854 179.194 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -65.71 -49.37 68.73 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.006 0.432 . . . . 0.0 110.642 -179.747 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 221' ' ' ILE . . . . . 0.453 HD13 ' HG ' ' B' ' 217' ' ' LEU . 1.3 mp -63.99 -43.02 97.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.331 179.613 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 89.1 t80 -60.37 -48.12 83.1 Favored 'General case' 0 C--N 1.314 -0.952 0 C-N-CA 120.609 -0.437 . . . . 0.0 110.939 -179.28 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 223' ' ' HIS . . . . . 0.572 ' CD2' ' CE1' ' A' ' 93' ' ' HIS . 12.0 t-160 -67.07 -35.15 79.19 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.15 179.759 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 23.3 t -74.18 -50.29 19.9 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.952 0.406 . . . . 0.0 111.336 -179.692 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 71.9 mm-40 -66.73 -22.01 66.06 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.673 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 10.5 t60 . . . . . 0 N--CA 1.453 -0.293 0 C-N-CA 120.664 -0.415 . . . . 0.0 110.487 -179.221 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ASP . . . . . 0.43 ' O ' ' HB3' ' A' ' 19' ' ' ALA . 30.8 m-20 . . . . . 0 C--O 1.245 0.82 0 CA-C-O 121.052 0.454 . . . . 0.0 110.678 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 10.2 t -53.64 -57.71 9.79 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.387 -178.868 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 17.2 mp0 -44.98 -47.46 11.46 Favored 'General case' 0 C--O 1.21 -0.992 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 179.291 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.43 ' HB3' ' O ' ' A' ' 16' ' ' ASP . . . -50.58 -56.45 11.65 Favored 'General case' 0 C--O 1.242 0.664 0 C-N-CA 120.425 -0.51 . . . . 0.0 110.008 -178.49 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.17 -53.5 48.34 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.756 179.453 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -51.3 -47.64 62.53 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.778 -179.439 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 70.8 tp60 -54.48 -51.98 63.35 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-O 120.921 0.391 . . . . 0.0 110.274 -179.266 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 88.8 t -64.34 -47.53 89.22 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.53 179.779 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.04 -44.87 83.35 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.092 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 11.3 t -56.05 -42.78 77.13 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 26.3 m -60.11 -50.33 74.14 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.476 179.424 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.467 ' N ' ' CD1' ' A' ' 27' ' ' LEU . 7.2 mp -68.06 -23.21 64.93 Favored 'General case' 0 CA--C 1.522 -0.128 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.572 179.214 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.5 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 52.7 tt0 -70.89 -66.81 0.56 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.321 -179.707 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.62 -53.54 57.18 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.882 0.372 . . . . 0.0 110.438 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.503 ' O ' ' O ' ' A' ' 31' ' ' ALA . 46.3 tp -45.2 -28.41 0.77 Allowed 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.631 -179.5 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.503 ' O ' ' O ' ' A' ' 30' ' ' LEU . . . -56.22 -124.4 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.29 179.387 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.464 ' O ' ' O ' ' A' ' 31' ' ' ALA . 85.5 m 55.77 111.26 0.02 OUTLIER Pre-proline 0 C--N 1.324 -0.516 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.319 179.263 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -48.42 -47.99 18.51 Favored 'Trans proline' 0 C--N 1.305 -1.715 0 C-N-CA 122.496 2.131 . . . . 0.0 112.605 -178.973 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 65.1 m -62.09 -46.62 88.29 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.174 -179.058 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 53.1 ttm-85 -61.21 -45.25 95.36 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.699 -178.512 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.564 HD23 ' O ' ' A' ' 36' ' ' LEU . 1.4 tt -59.97 -52.78 63.94 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.666 -0.414 . . . . 0.0 110.343 -178.653 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 11.3 tpt -51.24 -47.79 62.29 Favored 'General case' 0 C--O 1.238 0.475 0 C-N-CA 120.63 -0.428 . . . . 0.0 110.035 -179.727 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 35.4 mm -63.34 -43.09 98.43 Favored 'Isoleucine or valine' 0 C--O 1.246 0.883 0 CA-C-O 121.101 0.477 . . . . 0.0 110.652 179.461 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.572 HD13 ' O ' ' A' ' 39' ' ' LEU . 0.2 OUTLIER -62.46 -43.7 98.19 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.758 -179.422 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 19.3 m -58.29 -40.46 82.0 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.913 179.775 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 60.7 tp60 -58.0 -45.55 86.67 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.113 179.702 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.416 HD22 ' O ' ' A' ' 87' ' ' TYR . 11.4 mt -65.42 -39.21 91.86 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.255 178.105 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 3.4 tmt_? -53.64 -46.07 70.4 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.583 -178.534 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 29.2 t-20 -61.44 -38.79 88.45 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.994 0.426 . . . . 0.0 110.226 179.307 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.401 ' O ' HD12 ' A' ' 47' ' ' LEU . . . -173.55 157.11 25.4 Favored Glycine 0 CA--C 1.527 0.8 0 N-CA-C 111.074 -0.811 . . . . 0.0 111.074 179.511 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.446 ' O ' ' O ' ' A' ' 47' ' ' LEU . 51.9 Cg_endo -71.34 -74.58 0.01 OUTLIER 'Trans proline' 0 C--N 1.31 -1.49 0 C-N-CA 122.727 2.285 . . . . 0.0 112.697 179.769 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.446 ' O ' ' O ' ' A' ' 46' ' ' PRO . 0.5 OUTLIER 59.57 144.59 0.05 OUTLIER Pre-proline 0 C--N 1.321 -0.643 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.022 178.306 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -67.54 167.28 21.25 Favored 'Trans proline' 0 C--N 1.305 -1.712 0 C-N-CA 122.554 2.169 . . . . 0.0 111.877 178.96 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.81 HG12 ' OE1' ' A' ' 60' ' ' GLN . 66.9 t -58.69 -41.77 83.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.131 -179.925 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.424 ' H ' HG22 ' A' ' 50' ' ' THR . 0.0 OUTLIER -60.28 -41.5 93.47 Favored 'General case' 0 C--O 1.248 0.991 0 CA-C-O 121.471 0.653 . . . . 0.0 110.69 179.78 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -64.96 -38.66 91.69 Favored 'General case' 0 C--O 1.239 0.551 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.04 179.664 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 17.9 mt -62.44 -35.23 78.63 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.342 179.641 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.495 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -60.96 -46.33 91.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.785 178.678 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 70.3 mm-40 -57.61 -47.95 80.75 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 120.484 -0.487 . . . . 0.0 110.28 179.751 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.14 -44.58 88.16 Favored 'General case' 0 C--O 1.232 0.166 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.447 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 97.4 mt -97.62 -80.05 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.461 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' GLY . . . . . 0.495 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 156.94 103.19 0.2 Allowed Glycine 0 CA--C 1.526 0.723 0 N-CA-C 110.767 -0.933 . . . . 0.0 110.767 -179.624 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.517 ' O ' ' NE2' ' A' ' 60' ' ' GLN . 70.2 mmm 43.3 -114.84 0.34 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.109 0.481 . . . . 0.0 110.471 179.723 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 50.33 13.17 0.11 Allowed 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.417 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.81 ' OE1' HG12 ' A' ' 49' ' ' VAL . 3.2 mm-40 -50.85 -29.59 12.21 Favored 'General case' 0 C--O 1.238 0.498 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.667 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 3.0 t -72.98 -33.88 66.11 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.298 179.569 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.5 -38.96 74.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.123 -178.583 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.458 HG23 ' N ' ' A' ' 64' ' ' SER . 12.5 m -71.06 -47.02 63.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.568 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.458 ' N ' HG23 ' A' ' 63' ' ' VAL . 11.0 t -58.16 -43.96 87.67 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 -179.7 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' HIS . . . . . 0.411 ' O ' HG23 ' A' ' 69' ' ' VAL . 86.4 t60 -64.61 -51.05 64.72 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.845 179.66 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -61.72 -39.84 92.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.6 179.771 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.3 tp -60.91 -43.56 98.38 Favored 'General case' 0 C--O 1.218 -0.596 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.038 -179.822 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 72.3 ttt180 -60.73 -42.23 96.89 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-O 120.829 0.347 . . . . 0.0 110.316 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.411 HG23 ' O ' ' A' ' 65' ' ' HIS . 85.7 t -59.97 -54.75 30.42 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 C-N-CA 120.446 -0.502 . . . . 0.0 110.132 -179.201 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.453 ' N ' HD22 ' A' ' 70' ' ' LEU . 4.3 mm? -64.12 -37.83 88.86 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.584 179.079 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 60.1 ttt85 -52.25 -41.7 63.04 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.121 -179.477 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 -56.86 -45.75 82.27 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 120.587 -0.445 . . . . 0.0 110.293 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.0 mt -67.83 -39.06 83.93 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 110.021 -0.363 . . . . 0.0 110.021 179.61 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 96.74 46.47 2.48 Favored Glycine 0 CA--C 1.52 0.364 0 N-CA-C 110.989 -0.845 . . . . 0.0 110.989 -179.569 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 5.0 tp -105.78 -9.21 17.36 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.91 0.386 . . . . 0.0 110.763 -179.8 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.9 m -135.65 160.22 39.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.508 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -153.59 174.63 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.91 -179.703 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -143.85 156.48 26.68 Favored Glycine 0 C--N 1.332 0.34 0 N-CA-C 110.825 -0.91 . . . . 0.0 110.825 179.169 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 . . . . . 0 N--CA 1.466 0.349 0 CA-C-O 120.768 0.318 . . . . 0.0 110.4 -179.885 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 3.3 m . . . . . 0 N--CA 1.467 0.422 0 CA-C-O 120.622 0.249 . . . . 0.0 110.767 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.416 ' O ' HD22 ' A' ' 42' ' ' LEU . 71.7 m-85 -89.96 119.07 30.01 Favored 'General case' 0 C--O 1.22 -0.495 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.054 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 66.6 m -133.04 152.59 51.95 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-O 120.966 0.412 . . . . 0.0 110.385 -179.321 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 1.024 HD22 ' H ' ' A' ' 89' ' ' LEU . 0.5 OUTLIER -73.03 137.6 45.45 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.526 179.927 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 66.3 t80 -61.71 -50.31 72.94 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.736 -179.644 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 39.6 t0 -89.75 130.49 36.01 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.793 -179.717 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 11.8 m -93.45 -28.98 15.8 Favored 'General case' 0 C--O 1.244 0.777 0 CA-C-O 121.309 0.576 . . . . 0.0 110.389 179.345 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 75.9 m80 -55.21 -46.06 75.9 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.122 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.554 HG13 ' N ' ' A' ' 95' ' ' ALA . 13.1 p -53.05 -44.21 50.27 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.203 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.554 ' N ' HG13 ' A' ' 94' ' ' VAL . . . -57.08 -37.2 71.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.065 179.124 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -64.06 -38.93 92.87 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-O 121.23 0.538 . . . . 0.0 110.175 179.304 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 50.2 mt -61.21 -44.55 97.1 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.248 179.791 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.43 HD22 ' N ' ' A' ' 98' ' ' LEU . 4.2 mm? -66.94 -37.06 83.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.832 178.52 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -57.51 -47.26 82.43 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.189 -179.38 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.457 ' OE2' ' OE2' ' B' ' 219' ' ' GLU . 97.7 mt-10 -69.87 -52.31 25.84 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.548 179.238 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 101' ' ' ALA . . . . . 0.465 ' HB2' HD13 ' B' ' 216' ' ' LEU . . . -53.3 -46.82 69.53 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.519 -179.921 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 4.8 mm -62.52 -44.53 99.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.352 -179.377 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' TYR . . . . . 0.633 ' CE1' ' NE2' ' A' ' 107' ' ' HIS . 85.1 t80 -60.84 -46.89 88.78 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.989 0.423 . . . . 0.0 110.421 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 62.7 t60 -57.0 -39.73 75.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.614 -179.82 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 36.1 t -76.28 -40.35 51.96 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.161 179.647 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -56.78 -33.96 67.15 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.408 -179.213 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' HIS . . . . . 0.633 ' NE2' ' CE1' ' A' ' 103' ' ' TYR . 9.2 m-70 . . . . . 0 C--N 1.326 -0.437 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.513 179.66 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 135' ' ' ASP . . . . . 0.424 ' O ' ' HB3' ' B' ' 138' ' ' ALA . 18.3 m-20 . . . . . 0 C--O 1.247 0.927 0 CA-C-O 121.196 0.522 . . . . 0.0 110.725 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 10.0 t -54.07 -57.18 12.05 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.379 -178.64 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 14.0 mp0 -46.01 -47.27 16.82 Favored 'General case' 0 C--O 1.209 -1.038 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 179.351 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 138' ' ' ALA . . . . . 0.424 ' HB3' ' O ' ' B' ' 135' ' ' ASP . . . -50.04 -56.25 11.55 Favored 'General case' 0 C--O 1.242 0.706 0 C-N-CA 120.423 -0.511 . . . . 0.0 109.998 -178.348 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -64.5 -53.15 52.65 Favored 'General case' 0 N--CA 1.457 -0.108 0 C-N-CA 120.381 -0.528 . . . . 0.0 110.784 179.387 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -51.44 -46.13 62.9 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.875 -179.266 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 68.9 tp60 -55.75 -52.86 62.49 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 120.862 0.363 . . . . 0.0 110.171 -179.291 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 142' ' ' VAL . . . . . . . . . . . . . 90.4 t -63.51 -46.84 94.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.451 179.651 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -57.55 -45.75 84.74 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.394 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 11.3 t -56.07 -41.72 75.55 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 19.3 m -60.64 -49.05 79.06 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.358 179.647 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 146' ' ' LEU . . . . . 0.467 ' N ' ' CD1' ' B' ' 146' ' ' LEU . 7.3 mp -69.44 -22.33 63.67 Favored 'General case' 0 CA--C 1.522 -0.122 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.572 179.172 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 147' ' ' GLN . . . . . 0.525 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 54.4 tt0 -71.58 -66.04 0.68 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.195 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -59.17 -53.64 56.06 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.833 0.349 . . . . 0.0 110.321 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.52 ' O ' ' O ' ' B' ' 150' ' ' ALA . 39.0 tp -45.8 -29.45 1.34 Allowed 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.548 -179.703 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 150' ' ' ALA . . . . . 0.525 ' HB3' ' O ' ' B' ' 147' ' ' GLN . . . -55.46 -125.54 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.36 179.535 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 151' ' ' THR . . . . . 0.463 ' O ' ' O ' ' B' ' 150' ' ' ALA . 90.9 m 56.25 112.73 0.02 OUTLIER Pre-proline 0 N--CA 1.446 -0.633 0 CA-C-N 116.508 -0.314 . . . . 0.0 110.326 179.332 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -48.56 -49.14 15.32 Favored 'Trans proline' 0 C--N 1.305 -1.731 0 C-N-CA 122.47 2.113 . . . . 0.0 112.811 -179.284 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 46.0 m -61.49 -46.64 89.15 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.043 -178.748 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 54.0 ttm-85 -61.33 -44.88 96.45 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.669 -178.541 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 155' ' ' LEU . . . . . 0.581 HD23 ' O ' ' B' ' 155' ' ' LEU . 1.8 tt -60.47 -52.63 64.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.342 -178.594 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 11.3 tpt -51.17 -47.56 62.12 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 120.607 -0.437 . . . . 0.0 109.981 -179.59 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 35.5 mm -63.52 -42.67 96.98 Favored 'Isoleucine or valine' 0 C--O 1.247 0.967 0 CA-C-O 121.123 0.487 . . . . 0.0 110.636 179.216 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 158' ' ' LEU . . . . . 0.555 HD13 ' O ' ' B' ' 158' ' ' LEU . 0.2 OUTLIER -62.57 -42.84 99.8 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.796 -179.447 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 9.2 m -59.15 -41.92 89.5 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.786 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 60.2 tp60 -56.56 -45.77 81.1 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 121.002 0.429 . . . . 0.0 110.298 179.815 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 161' ' ' LEU . . . . . 0.438 HD22 ' O ' ' B' ' 206' ' ' TYR . 12.7 mt -65.7 -38.3 88.87 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.195 178.316 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 162' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -55.29 -44.27 75.57 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.581 -178.59 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -63.69 -39.24 93.83 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.233 179.214 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 164' ' ' GLY . . . . . 0.428 ' O ' HD12 ' B' ' 166' ' ' LEU . . . -172.66 155.53 23.3 Favored Glycine 0 CA--C 1.528 0.884 0 N-CA-C 111.111 -0.796 . . . . 0.0 111.111 179.547 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 165' ' ' PRO . . . . . 0.43 ' O ' ' O ' ' B' ' 166' ' ' LEU . 49.4 Cg_endo -70.74 -75.56 0.01 OUTLIER 'Trans proline' 0 C--N 1.31 -1.453 0 C-N-CA 122.761 2.307 . . . . 0.0 112.583 179.736 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 166' ' ' LEU . . . . . 0.43 ' O ' ' O ' ' B' ' 165' ' ' PRO . 0.4 OUTLIER 60.08 144.07 0.05 OUTLIER Pre-proline 0 C--N 1.32 -0.675 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.028 178.319 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -66.6 167.14 19.81 Favored 'Trans proline' 0 C--N 1.305 -1.757 0 C-N-CA 122.58 2.186 . . . . 0.0 112.127 179.504 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 168' ' ' VAL . . . . . 0.805 HG12 ' OE1' ' B' ' 179' ' ' GLN . 55.0 t -58.24 -41.93 82.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.897 -179.923 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 169' ' ' THR . . . . . 0.438 ' H ' HG22 ' B' ' 169' ' ' THR . 0.0 OUTLIER -60.2 -41.74 93.63 Favored 'General case' 0 C--O 1.247 0.931 0 CA-C-O 121.501 0.667 . . . . 0.0 110.701 179.69 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -64.5 -38.45 91.06 Favored 'General case' 0 C--O 1.239 0.527 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.127 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 18.9 mt -62.14 -36.1 80.78 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.356 179.49 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 172' ' ' ALA . . . . . 0.474 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -60.66 -46.27 90.98 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.922 178.936 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -57.76 -48.13 80.54 Favored 'General case' 0 C--O 1.236 0.342 0 C-N-CA 120.553 -0.459 . . . . 0.0 110.285 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -65.03 -45.57 84.88 Favored 'General case' 0 C--O 1.232 0.163 0 C-N-CA 120.696 -0.402 . . . . 0.0 110.633 179.712 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 97.0 mt -96.8 -79.08 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.604 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 176' ' ' GLY . . . . . 0.474 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 156.86 103.3 0.2 Allowed Glycine 0 CA--C 1.525 0.666 0 N-CA-C 110.74 -0.944 . . . . 0.0 110.74 -179.683 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 177' ' ' MET . . . . . 0.538 ' O ' ' NE2' ' B' ' 179' ' ' GLN . 74.7 mtp 41.35 -113.16 0.18 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.181 0.515 . . . . 0.0 110.578 179.823 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 50.09 11.9 0.07 Allowed 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.305 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 179' ' ' GLN . . . . . 0.805 ' OE1' HG12 ' B' ' 168' ' ' VAL . 2.7 mm-40 -48.74 -29.33 4.37 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.752 179.778 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 38.9 m -73.04 -33.93 65.99 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.307 179.704 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -70.02 -38.87 76.02 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.119 -178.734 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 182' ' ' VAL . . . . . 0.446 HG23 ' N ' ' B' ' 183' ' ' SER . 11.0 m -71.42 -47.19 60.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.483 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 183' ' ' SER . . . . . 0.446 ' N ' HG23 ' B' ' 182' ' ' VAL . 10.5 t -57.73 -44.1 85.77 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 184' ' ' HIS . . . . . 0.409 ' O ' HG23 ' B' ' 188' ' ' VAL . 86.1 t60 -65.58 -51.71 57.68 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.809 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -60.99 -41.54 96.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.534 179.808 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 7.5 tp -59.53 -44.21 93.26 Favored 'General case' 0 C--O 1.216 -0.665 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.201 -179.668 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 72.9 ttt180 -60.09 -42.64 95.07 Favored 'General case' 0 C--O 1.242 0.671 0 CA-C-O 120.991 0.424 . . . . 0.0 110.414 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 188' ' ' VAL . . . . . 0.409 HG23 ' O ' ' B' ' 184' ' ' HIS . 88.7 t -59.46 -54.46 34.08 Favored 'Isoleucine or valine' 0 C--O 1.232 0.135 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.012 -179.211 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 189' ' ' LEU . . . . . 0.456 ' N ' ' CD2' ' B' ' 189' ' ' LEU . 4.1 mm? -64.42 -38.08 89.78 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.572 178.872 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 61.2 ttt85 -51.23 -39.72 57.25 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.321 -179.608 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -60.36 -40.1 89.56 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.809 0.337 . . . . 0.0 110.237 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 192' ' ' LEU . . . . . 0.431 HD23 ' N ' ' B' ' 192' ' ' LEU . 7.4 mt -71.59 -37.72 70.96 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.489 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 95.19 42.5 3.73 Favored Glycine 0 CA--C 1.522 0.502 0 N-CA-C 110.766 -0.934 . . . . 0.0 110.766 -179.282 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 5.1 tp -103.99 -9.55 18.77 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.794 0.33 . . . . 0.0 110.921 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 195' ' ' VAL . . . . . 0.413 ' O ' HG13 ' B' ' 196' ' ' VAL . 3.4 m -135.71 159.78 39.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.659 -179.919 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 196' ' ' VAL . . . . . 0.413 HG13 ' O ' ' B' ' 195' ' ' VAL . 0.2 OUTLIER -155.2 176.39 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.823 -179.83 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 197' ' ' GLY . . . . . . . . . . . . . . . -145.47 158.3 27.61 Favored Glycine 0 CA--C 1.52 0.397 0 N-CA-C 110.723 -0.951 . . . . 0.0 110.723 179.719 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 . . . . . 0 N--CA 1.466 0.375 0 CA-C-O 120.673 0.273 . . . . 0.0 110.368 -179.881 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 3.0 m . . . . . 0 N--CA 1.466 0.345 0 CA-C-O 120.568 0.223 . . . . 0.0 110.719 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 206' ' ' TYR . . . . . 0.438 ' O ' HD22 ' B' ' 161' ' ' LEU . 71.9 m-85 -90.37 118.33 29.78 Favored 'General case' 0 C--O 1.219 -0.533 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.005 -179.776 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 63.7 m -133.46 152.68 51.94 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.013 0.435 . . . . 0.0 110.327 -179.309 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 208' ' ' LEU . . . . . 1.031 HD22 ' H ' ' B' ' 208' ' ' LEU . 0.5 OUTLIER -73.37 136.52 44.39 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.652 179.845 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 209' ' ' TYR . . . . . 0.407 ' H ' ' HA ' ' B' ' 195' ' ' VAL . 63.4 t80 -61.68 -47.65 84.36 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.554 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -90.29 129.36 36.53 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.695 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 23.6 m -94.02 -31.06 14.39 Favored 'General case' 0 C--O 1.244 0.808 0 CA-C-O 121.334 0.587 . . . . 0.0 110.304 179.43 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 212' ' ' HIS . . . . . . . . . . . . . 75.3 m80 -54.44 -45.09 73.0 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 115.89 -0.595 . . . . 0.0 109.995 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 213' ' ' VAL . . . . . 0.569 HG13 ' N ' ' B' ' 214' ' ' ALA . 13.1 p -52.82 -43.67 46.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.054 0.454 . . . . 0.0 110.124 179.836 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 214' ' ' ALA . . . . . 0.569 ' N ' HG13 ' B' ' 213' ' ' VAL . . . -57.69 -38.12 74.64 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.014 179.053 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 57.2 tt0 -62.72 -39.5 94.26 Favored 'General case' 0 C--O 1.238 0.459 0 CA-C-O 121.258 0.551 . . . . 0.0 110.119 179.318 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 216' ' ' LEU . . . . . 0.465 HD13 ' HB2' ' A' ' 101' ' ' ALA . 48.9 mt -61.38 -44.87 96.41 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.298 179.841 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 217' ' ' LEU . . . . . 0.401 ' N ' ' CD2' ' B' ' 217' ' ' LEU . 4.1 mm? -66.45 -37.3 84.84 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.886 178.383 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -57.59 -47.36 82.32 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.14 -179.042 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 219' ' ' GLU . . . . . 0.457 ' OE2' ' OE2' ' A' ' 100' ' ' GLU . 94.6 mt-10 -69.91 -51.5 32.49 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.607 179.185 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -53.64 -47.68 70.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.459 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 4.4 mm -62.07 -44.76 99.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.432 -179.251 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 222' ' ' TYR . . . . . 0.593 ' CE1' ' NE2' ' B' ' 226' ' ' HIS . 74.5 t80 -60.09 -47.37 86.16 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.943 0.402 . . . . 0.0 110.427 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 223' ' ' HIS . . . . . . . . . . . . . 62.0 t60 -56.75 -39.24 73.64 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.586 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 32.9 t -76.74 -40.53 48.19 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.066 179.778 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 82.9 tt0 -56.78 -34.85 68.03 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.355 -179.254 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 226' ' ' HIS . . . . . 0.593 ' NE2' ' CE1' ' B' ' 222' ' ' TYR . 8.0 m-70 . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.483 179.803 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ASP . . . . . 0.523 ' O ' ' N ' ' A' ' 19' ' ' ALA . 98.9 m-20 . . . . . 0 C--O 1.232 0.161 0 CA-C-O 120.6 0.238 . . . . 0.0 110.722 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.405 ' C ' ' O ' ' A' ' 16' ' ' ASP . 91.3 p -38.31 -38.5 0.36 Allowed 'General case' 0 C--O 1.24 0.583 0 CA-C-O 121.231 0.539 . . . . 0.0 110.6 -179.509 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 25.1 pt20 -65.33 -44.02 89.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.328 179.144 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.544 ' O ' HG23 ' A' ' 23' ' ' VAL . . . -63.67 -28.6 70.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.202 179.456 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.36 -51.73 48.64 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.239 179.68 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.06 -46.5 89.36 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.71 179.821 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -54.48 -50.58 67.42 Favored 'General case' 0 C--O 1.241 0.648 0 CA-C-O 121.177 0.513 . . . . 0.0 110.471 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.544 HG23 ' O ' ' A' ' 19' ' ' ALA . 92.2 t -62.76 -44.73 99.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.42 179.573 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.554 ' HB1' ' N ' ' B' ' 151' ' ' THR . . . -53.6 -44.05 69.11 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 10.9 t -59.91 -43.88 94.6 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 11.1 m -63.73 -46.95 83.06 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.025 0.441 . . . . 0.0 110.39 179.289 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 95.4 mt -67.26 -21.12 65.73 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.643 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 58.2 tt0 -75.81 -56.36 4.75 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.637 179.329 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.12 -54.61 45.02 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.448 -179.466 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.486 ' O ' ' O ' ' A' ' 31' ' ' ALA . 93.3 mt -47.56 -41.96 22.56 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.557 -179.205 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.517 ' O ' ' CB ' ' A' ' 32' ' ' THR . . . -50.04 -174.97 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.017 179.752 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.544 ' N ' ' HB1' ' B' ' 143' ' ' ALA . 1.0 OUTLIER 88.37 118.3 0.03 OUTLIER Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.031 179.961 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -46.7 -46.58 17.69 Favored 'Trans proline' 0 N--CA 1.496 1.659 0 C-N-CA 122.368 2.045 . . . . 0.0 113.113 -178.662 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 11.6 t -58.97 -44.5 91.55 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.813 -179.118 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 22.5 mmt85 -62.0 -46.15 90.46 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 120.675 -0.41 . . . . 0.0 110.984 -179.315 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.467 ' CD2' ' O ' ' A' ' 30' ' ' LEU . 4.2 mm? -62.87 -47.31 83.88 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.974 -179.567 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.5 ' SD ' HD11 ' A' ' 56' ' ' ILE . 14.3 tmm? -58.32 -49.22 77.97 Favored 'General case' 0 C--N 1.32 -0.677 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.545 -179.673 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 32.9 mm -63.96 -44.62 97.96 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.789 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 49.3 mt -62.12 -42.35 99.14 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.754 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 19.5 m -60.16 -41.32 92.56 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.2 -0.455 . . . . 0.0 109.896 179.554 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.539 ' N ' ' OE1' ' A' ' 41' ' ' GLN . 0.1 OUTLIER -57.85 -49.68 75.86 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.262 -0.426 . . . . 0.0 109.928 179.992 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 98.3 mt -63.77 -42.55 97.76 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.455 -0.498 . . . . 0.0 110.685 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 72.7 ttp85 -71.53 -21.12 61.95 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.646 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 62.0 t-20 -62.46 -41.22 98.61 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.934 0.397 . . . . 0.0 110.48 -179.541 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 159.34 -166.59 34.78 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 111.088 -0.805 . . . . 0.0 111.088 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_exo -73.51 115.51 4.36 Favored 'Trans proline' 0 N--CA 1.492 1.415 0 C-N-CA 122.888 2.392 . . . . 0.0 112.151 179.82 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.449 ' O ' ' O ' ' A' ' 48' ' ' PRO . 0.3 OUTLIER -158.34 84.61 2.58 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.106 179.911 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 48' ' ' PRO . . . . . 0.449 ' O ' ' O ' ' A' ' 47' ' ' LEU . 51.2 Cg_exo -51.14 -166.57 0.0 OUTLIER 'Trans proline' 0 C--N 1.303 -1.855 0 C-N-CA 122.471 2.114 . . . . 0.0 112.385 179.699 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 55.0 t -59.69 -51.06 77.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 121.072 0.463 . . . . 0.0 111.291 -179.265 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.423 HG22 ' H ' ' A' ' 50' ' ' THR . 0.1 OUTLIER -57.33 -44.84 84.57 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.257 0.551 . . . . 0.0 109.921 179.957 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 -65.09 -33.99 77.34 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.592 -0.522 . . . . 0.0 109.592 179.429 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.591 ' O ' HD13 ' A' ' 52' ' ' LEU . 0.2 OUTLIER -62.05 -43.26 99.21 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 120.541 -0.463 . . . . 0.0 110.09 -179.777 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.81 -45.04 96.01 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.587 179.407 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 41.1 tp10 -65.03 -30.42 71.4 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.369 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -70.28 -53.98 14.56 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.853 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.5 HD11 ' SD ' ' A' ' 37' ' ' MET . 90.2 mt -94.26 -68.67 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.247 179.858 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 134.2 97.72 0.6 Allowed Glycine 0 C--N 1.332 0.322 0 N-CA-C 111.348 -0.701 . . . . 0.0 111.348 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 65.6 mtt 60.02 97.38 0.03 OUTLIER 'General case' 0 CA--C 1.519 -0.212 0 C-N-CA 120.819 -0.352 . . . . 0.0 110.928 178.928 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -179.6 19.15 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.488 179.875 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 56.0 mt-30 -54.4 -26.72 32.16 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.365 0.602 . . . . 0.0 110.797 -179.047 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 78.1 p -74.39 -31.48 62.36 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.237 179.353 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -74.6 -38.98 62.46 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.446 -178.802 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.599 HG13 ' N ' ' A' ' 64' ' ' SER . 7.6 p -73.81 -50.63 28.21 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 CA-C-N 116.515 -0.312 . . . . 0.0 110.381 179.898 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.599 ' N ' HG13 ' A' ' 63' ' ' VAL . 45.4 t -58.37 -43.76 88.58 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 120.509 -0.477 . . . . 0.0 110.362 -179.787 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' HIS . . . . . 0.472 ' O ' HG23 ' A' ' 69' ' ' VAL . 55.6 t-80 -67.0 -45.55 77.24 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.859 179.686 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -63.86 -48.49 76.51 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.974 -179.192 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -61.84 -44.55 96.62 Favored 'General case' 0 CA--C 1.503 -0.829 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.877 -179.343 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 60.8 ttp180 -59.55 -44.35 93.27 Favored 'General case' 0 C--N 1.315 -0.891 0 CA-C-O 121.059 0.457 . . . . 0.0 110.377 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.472 HG23 ' O ' ' A' ' 65' ' ' HIS . 47.9 t -59.24 -51.83 67.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 C-N-CA 120.344 -0.542 . . . . 0.0 110.055 -179.85 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 95.6 mt -67.9 -27.68 66.85 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.976 0.417 . . . . 0.0 110.467 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 74.2 ttt180 -62.31 -42.43 99.36 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.408 -179.695 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 -60.56 -44.52 96.08 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 120.599 -0.441 . . . . 0.0 110.357 -179.672 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 10.2 mt -65.3 -39.01 91.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.318 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 99.4 60.05 0.87 Allowed Glycine 0 N--CA 1.462 0.403 0 N-CA-C 110.717 -0.953 . . . . 0.0 110.717 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 27.9 tp -118.53 -15.91 9.55 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 121.006 0.431 . . . . 0.0 110.352 -179.801 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 21.2 m -131.37 163.64 36.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.087 0.47 . . . . 0.0 110.281 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.582 HG12 ' N ' ' A' ' 78' ' ' GLY . 91.9 t -143.62 163.22 15.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.803 -179.481 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' GLY . . . . . 0.582 ' N ' HG12 ' A' ' 77' ' ' VAL . . . -108.56 161.24 13.35 Favored Glycine 0 CA--C 1.524 0.597 0 N-CA-C 110.584 -1.006 . . . . 0.0 110.584 179.606 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 . . . . . 0 C--N 1.328 -0.368 0 CA-C-O 120.761 0.315 . . . . 0.0 110.568 179.798 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 70.2 t . . . . . 0 N--CA 1.464 0.26 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 64.4 m-85 -90.93 124.6 35.33 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.387 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 65.5 m -138.67 158.79 43.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.516 -179.598 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 18.2 mt -66.88 140.47 57.79 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.315 -179.563 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.405 ' CD1' ' C ' ' A' ' 90' ' ' TYR . 14.5 t80 -57.12 -50.7 71.98 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.642 -179.76 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -100.98 134.27 44.22 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.879 0.371 . . . . 0.0 110.608 -179.486 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 70.8 p -74.26 -26.66 60.34 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.363 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 74.0 m80 -56.36 -43.69 79.38 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.338 -179.772 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 75.0 t -56.94 -43.06 79.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -179.706 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.37 -43.03 99.57 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.252 179.497 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 68.1 tp60 -64.34 -42.59 96.18 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.177 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 12.6 tp -59.02 -43.66 91.61 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.964 -179.373 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 90.4 mt -64.34 -39.71 94.44 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.191 179.444 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -58.92 -42.39 89.56 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.437 -179.743 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -66.16 -53.71 34.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.514 179.811 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.95 -41.06 86.54 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.021 0.438 . . . . 0.0 110.49 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 4.0 mm -61.63 -44.58 98.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.519 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' TYR . . . . . 0.508 ' O ' ' ND1' ' A' ' 107' ' ' HIS . 4.0 m-85 -66.21 -38.29 87.61 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.139 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 3.8 t60 -58.64 -42.81 89.19 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.589 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 29.8 t -79.45 -36.61 38.58 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.036 0.446 . . . . 0.0 111.22 179.386 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 48.1 tp10 -55.68 -40.77 72.76 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.433 -178.983 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' HIS . . . . . 0.508 ' ND1' ' O ' ' A' ' 103' ' ' TYR . 36.0 m80 . . . . . 0 N--CA 1.453 -0.292 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 -179.196 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 135' ' ' ASP . . . . . 0.503 ' O ' ' N ' ' B' ' 138' ' ' ALA . 94.4 m-20 . . . . . 0 C--O 1.232 0.161 0 CA-C-O 120.555 0.217 . . . . 0.0 110.624 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 69.3 p -38.35 -38.65 0.38 Allowed 'General case' 0 C--O 1.239 0.512 0 CA-C-O 121.285 0.564 . . . . 0.0 110.423 -179.577 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 137' ' ' GLN . . . . . 0.419 ' CG ' ' N ' ' B' ' 138' ' ' ALA . 23.5 pt20 -65.9 -45.18 82.93 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.398 179.174 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 138' ' ' ALA . . . . . 0.516 ' O ' HG23 ' B' ' 142' ' ' VAL . . . -63.18 -28.16 69.86 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.163 179.708 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.28 -50.82 51.13 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.28 179.703 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -60.33 -46.32 90.3 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.534 179.724 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -54.39 -51.32 65.21 Favored 'General case' 0 C--O 1.241 0.646 0 CA-C-O 121.27 0.557 . . . . 0.0 110.544 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 142' ' ' VAL . . . . . 0.516 HG23 ' O ' ' B' ' 138' ' ' ALA . 90.5 t -62.7 -45.88 97.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.451 179.686 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 143' ' ' ALA . . . . . 0.544 ' HB1' ' N ' ' A' ' 32' ' ' THR . . . -52.05 -44.58 64.32 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 36.7 t -59.43 -44.44 92.9 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.039 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 8.1 m -63.68 -47.06 82.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.485 179.511 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 93.6 mt -66.53 -20.69 66.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.621 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 147' ' ' GLN . . . . . 0.416 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 58.8 tt0 -75.78 -56.85 4.29 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.585 179.287 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -57.93 -54.71 43.83 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.362 -179.424 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.483 ' O ' ' O ' ' B' ' 150' ' ' ALA . 94.2 mt -46.93 -41.7 16.49 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.359 -179.245 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 150' ' ' ALA . . . . . 0.519 ' O ' ' CB ' ' B' ' 151' ' ' THR . . . -50.6 -174.33 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.147 -0.479 . . . . 0.0 109.978 179.651 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 151' ' ' THR . . . . . 0.554 ' N ' ' HB1' ' A' ' 24' ' ' ALA . 1.0 OUTLIER 88.14 117.84 0.03 OUTLIER Pre-proline 0 CA--C 1.538 0.518 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 179.833 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -46.74 -46.47 18.03 Favored 'Trans proline' 0 N--CA 1.495 1.586 0 C-N-CA 122.322 2.015 . . . . 0.0 113.063 -178.518 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 48.1 t -58.97 -44.42 91.53 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.969 -179.253 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 20.7 mmt85 -61.78 -45.91 91.84 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.739 -0.385 . . . . 0.0 111.042 -179.463 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 155' ' ' LEU . . . . . 0.461 ' CD2' ' O ' ' B' ' 149' ' ' LEU . 4.2 mm? -62.76 -47.71 82.35 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 120.598 -0.441 . . . . 0.0 111.073 -179.853 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 156' ' ' MET . . . . . 0.527 ' SD ' HD11 ' B' ' 175' ' ' ILE . 14.4 tmm? -58.29 -49.24 77.84 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 120.337 -0.545 . . . . 0.0 110.612 -179.859 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 5.9 mm -64.4 -44.91 97.16 Favored 'Isoleucine or valine' 0 C--O 1.239 0.507 0 CA-C-O 121.098 0.475 . . . . 0.0 110.823 -179.504 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 57.7 mt -62.09 -41.77 98.53 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.599 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 28.0 m -59.75 -41.9 92.02 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.179 -0.464 . . . . 0.0 109.815 179.292 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 160' ' ' GLN . . . . . 0.55 ' OE1' ' N ' ' B' ' 160' ' ' GLN . 0.0 OUTLIER -58.02 -49.24 77.55 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.854 -0.425 . . . . 0.0 109.854 179.958 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 161' ' ' LEU . . . . . . . . . . . . . 97.5 mt -63.95 -42.75 97.21 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 120.373 -0.531 . . . . 0.0 110.573 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 162' ' ' ARG . . . . . . . . . . . . . 72.5 ttp85 -71.3 -21.0 62.13 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.51 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 59.4 t-20 -63.18 -41.87 99.27 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.579 -179.53 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . 162.26 -165.44 36.01 Favored Glycine 0 CA--C 1.528 0.853 0 N-CA-C 111.017 -0.833 . . . . 0.0 111.017 -179.828 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -79.06 112.98 3.15 Favored 'Trans proline' 0 C--N 1.31 -1.486 0 C-N-CA 122.958 2.439 . . . . 0.0 111.769 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 166' ' ' LEU . . . . . 0.436 ' O ' ' O ' ' B' ' 167' ' ' PRO . 0.3 OUTLIER -153.35 85.86 4.11 Favored Pre-proline 0 C--N 1.325 -0.486 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.264 -178.935 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 167' ' ' PRO . . . . . 0.436 ' O ' ' O ' ' B' ' 166' ' ' LEU . 51.4 Cg_exo -50.69 -167.94 0.0 OUTLIER 'Trans proline' 0 C--N 1.306 -1.692 0 C-N-CA 122.607 2.205 . . . . 0.0 112.243 179.76 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . 80.0 t -59.59 -50.41 80.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.973 -179.209 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 169' ' ' THR . . . . . 0.43 ' H ' HG22 ' B' ' 169' ' ' THR . 0.0 OUTLIER -57.54 -44.77 85.44 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.281 0.562 . . . . 0.0 109.976 -179.835 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 -65.51 -34.69 78.85 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.632 179.657 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 171' ' ' LEU . . . . . 0.603 ' O ' HD13 ' B' ' 171' ' ' LEU . 0.2 OUTLIER -61.62 -44.47 96.92 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 120.466 -0.493 . . . . 0.0 110.02 -179.614 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 172' ' ' ALA . . . . . . . . . . . . . . . -60.39 -44.33 95.78 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 179.397 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 45.3 tp10 -64.89 -30.65 71.66 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.388 179.736 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -69.92 -54.46 13.3 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.846 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 175' ' ' ILE . . . . . 0.527 HD11 ' SD ' ' B' ' 156' ' ' MET . 93.1 mt -93.56 -68.18 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.293 179.848 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . 133.46 96.75 0.6 Allowed Glycine 0 C--N 1.332 0.333 0 N-CA-C 111.317 -0.713 . . . . 0.0 111.317 -179.887 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 61.6 mtt 61.91 96.68 0.03 OUTLIER 'General case' 0 CA--C 1.52 -0.19 0 CA-C-O 120.713 0.292 . . . . 0.0 110.765 178.631 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -178.93 19.02 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.58 179.577 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 56.0 mt-30 -54.23 -27.24 33.36 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.36 0.6 . . . . 0.0 110.848 -179.059 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 78.5 p -74.41 -32.71 62.77 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.394 179.546 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -73.29 -38.75 65.77 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.584 -178.741 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 182' ' ' VAL . . . . . 0.583 HG13 ' N ' ' B' ' 183' ' ' SER . 7.3 p -73.42 -49.73 35.04 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.509 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.436 179.975 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 183' ' ' SER . . . . . 0.583 ' N ' HG13 ' B' ' 182' ' ' VAL . 43.0 t -58.09 -43.77 87.26 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 120.706 -0.397 . . . . 0.0 110.129 -179.533 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 184' ' ' HIS . . . . . 0.495 ' O ' HG23 ' B' ' 188' ' ' VAL . 54.7 t-80 -67.16 -45.01 78.29 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.618 179.687 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -63.65 -49.76 71.97 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.708 -179.411 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -61.31 -44.27 97.48 Favored 'General case' 0 CA--C 1.502 -0.888 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.789 -179.532 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 60.5 ttp180 -59.62 -44.9 93.28 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.143 0.497 . . . . 0.0 110.469 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 188' ' ' VAL . . . . . 0.495 HG23 ' O ' ' B' ' 184' ' ' HIS . 44.2 t -58.93 -52.17 63.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.196 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 86.1 mt -67.82 -28.38 67.52 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.938 0.399 . . . . 0.0 110.361 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 74.9 ttt180 -61.52 -42.34 98.67 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.412 -179.701 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -60.49 -45.36 94.04 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.71 -0.396 . . . . 0.0 110.437 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 192' ' ' LEU . . . . . . . . . . . . . 10.0 mt -65.03 -40.13 94.38 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.315 179.776 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 101.0 53.85 1.0 Allowed Glycine 0 N--CA 1.462 0.412 0 N-CA-C 111.005 -0.838 . . . . 0.0 111.005 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 14.9 tp -111.94 -15.06 13.4 Favored 'General case' 0 N--CA 1.462 0.125 0 CA-C-O 120.885 0.374 . . . . 0.0 110.618 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 23.9 m -132.13 163.76 36.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 121.015 0.436 . . . . 0.0 110.349 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 196' ' ' VAL . . . . . 0.598 HG12 ' N ' ' B' ' 197' ' ' GLY . 96.4 t -144.33 163.42 14.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.686 -179.6 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 197' ' ' GLY . . . . . 0.598 ' N ' HG12 ' B' ' 196' ' ' VAL . . . -109.21 160.04 13.74 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.534 -1.026 . . . . 0.0 110.534 179.598 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 . . . . . 0 C--N 1.327 -0.388 0 CA-C-O 120.738 0.304 . . . . 0.0 110.734 179.971 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 69.8 t . . . . . 0 N--CA 1.464 0.242 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 59.0 m-85 -91.8 125.12 36.39 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.512 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 67.8 m -139.26 158.53 43.99 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.502 -179.549 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . 15.9 mt -66.91 138.91 57.64 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.457 -179.693 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 15.2 t80 -54.77 -51.99 64.0 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.674 -179.772 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 63.8 m-20 -99.85 135.36 41.39 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.827 0.346 . . . . 0.0 110.673 -179.396 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 76.2 p -75.74 -24.26 56.09 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.374 179.709 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 212' ' ' HIS . . . . . . . . . . . . . 74.3 m80 -57.32 -43.48 83.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.289 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 74.5 t -57.67 -43.58 83.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 214' ' ' ALA . . . . . . . . . . . . . . . -59.7 -45.61 91.59 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.366 179.478 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 69.5 tp60 -63.63 -41.94 98.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.265 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 216' ' ' LEU . . . . . . . . . . . . . 14.6 tp -59.05 -43.93 91.73 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.025 -179.283 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 82.1 mt -64.51 -39.41 93.73 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.099 179.526 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -58.82 -42.3 88.89 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.514 -179.778 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 219' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -67.14 -51.43 54.04 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.534 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -59.77 -41.48 91.18 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.062 0.458 . . . . 0.0 110.406 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 4.4 mm -61.78 -44.04 98.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.674 -179.714 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 222' ' ' TYR . . . . . 0.432 ' O ' ' ND1' ' B' ' 226' ' ' HIS . 4.2 m-85 -66.36 -38.53 87.79 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.271 179.936 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 223' ' ' HIS . . . . . . . . . . . . . 3.3 t60 -58.48 -43.08 88.86 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.526 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 37.5 t -77.89 -36.27 49.81 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.9 179.494 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 37.0 tp10 -59.86 -30.94 69.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.529 -179.276 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 226' ' ' HIS . . . . . 0.432 ' ND1' ' O ' ' B' ' 222' ' ' TYR . 27.3 m80 . . . . . 0 CA--C 1.507 -0.704 0 CA-C-O 118.681 -0.676 . . . . 0.0 111.264 -179.707 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ASP . . . . . 0.525 ' O ' ' N ' ' A' ' 19' ' ' ALA . 99.2 m-20 . . . . . 0 CA--C 1.523 -0.086 0 CA-C-O 120.416 0.15 . . . . 0.0 110.63 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 86.4 p -38.46 -40.16 0.53 Allowed 'General case' 0 C--O 1.236 0.368 0 CA-C-O 121.239 0.542 . . . . 0.0 110.473 -179.788 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 94.8 mm-40 -65.49 -42.93 91.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.191 179.235 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.525 ' N ' ' O ' ' A' ' 16' ' ' ASP . . . -65.79 -28.77 69.26 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.501 179.407 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.61 -52.84 27.13 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.376 179.718 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.8 -49.58 76.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.914 0.387 . . . . 0.0 111.153 179.563 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 66.5 tp60 -53.62 -50.11 66.39 Favored 'General case' 0 C--O 1.242 0.682 0 CA-C-O 121.722 0.772 . . . . 0.0 109.996 -179.559 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.424 HG23 ' O ' ' A' ' 19' ' ' ALA . 57.7 t -62.59 -41.76 93.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.639 -0.709 . . . . 0.0 109.689 179.517 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.462 ' HB2' HD12 ' B' ' 155' ' ' LEU . . . -50.68 -47.43 58.81 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.176 179.785 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 40.3 t -60.22 -43.84 95.67 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.318 -0.401 . . . . 0.0 109.982 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 24.2 m -63.24 -51.77 64.87 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.253 -0.579 . . . . 0.0 110.934 179.72 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 88.6 mt -67.76 -21.1 65.28 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.761 -179.603 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.428 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 52.7 tt0 -75.05 -60.56 2.24 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.759 179.467 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.494 ' HB1' ' NH1' ' A' ' 35' ' ' ARG . . . -58.33 -53.04 62.74 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.863 -179.063 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.432 ' O ' ' C ' ' A' ' 31' ' ' ALA . 4.0 mm? -51.23 -41.37 60.27 Favored 'General case' 0 CA--C 1.509 -0.634 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 -178.475 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.563 ' O ' ' C ' ' A' ' 32' ' ' THR . . . -39.22 -70.81 0.09 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.431 179.757 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.563 ' C ' ' O ' ' A' ' 31' ' ' ALA . 7.1 p -3.35 107.16 0.03 OUTLIER Pre-proline 0 N--CA 1.48 1.027 0 O-C-N 124.583 1.177 . . . . 0.0 111.018 -179.685 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -47.3 -48.47 15.0 Favored 'Trans proline' 0 C--N 1.307 -1.611 0 C-N-CA 122.073 1.849 . . . . 0.0 113.31 -177.635 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 11.1 t -57.62 -44.14 85.28 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.659 -179.297 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.494 ' NH1' ' HB1' ' A' ' 29' ' ' ALA . 38.5 ttm180 -61.18 -45.24 95.43 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 120.643 -0.423 . . . . 0.0 110.71 -179.886 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.548 ' O ' HG23 ' A' ' 40' ' ' THR . 80.3 mt -57.69 -52.28 66.09 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.313 -0.555 . . . . 0.0 110.707 -179.761 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.43 ' O ' ' OG1' ' A' ' 40' ' ' THR . 53.9 ttp -53.63 -46.23 70.42 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.221 -0.592 . . . . 0.0 110.583 179.412 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.603 HD12 HE22 ' A' ' 66' ' ' GLN . 97.5 mt -62.36 -48.03 90.26 Favored 'Isoleucine or valine' 0 C--O 1.239 0.529 0 CA-C-O 121.332 0.587 . . . . 0.0 110.798 -179.572 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -61.89 -41.56 98.03 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.575 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.548 HG23 ' O ' ' A' ' 36' ' ' LEU . 37.4 p -61.77 -33.98 75.06 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.988 179.956 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 60.8 tp60 -64.47 -50.49 67.27 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 120.603 -0.439 . . . . 0.0 109.897 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 16.6 mt -62.86 -30.45 71.52 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.495 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 10.8 ttm180 -42.58 -41.29 2.99 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.586 -179.512 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 95.1 m-20 -62.36 -42.92 99.78 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.981 0.42 . . . . 0.0 110.186 -179.747 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 162.23 178.32 36.01 Favored Glycine 0 CA--C 1.527 0.8 0 C-N-CA 120.559 -0.829 . . . . 0.0 111.361 179.027 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 15.1 Cg_exo -67.33 148.07 79.21 Favored 'Trans proline' 0 N--CA 1.49 1.28 0 C-N-CA 122.85 2.367 . . . . 0.0 111.899 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.569 HD12 ' O ' ' A' ' 47' ' ' LEU . 0.3 OUTLIER -164.43 159.4 15.86 Favored Pre-proline 0 CA--C 1.536 0.414 0 C-N-CA 120.262 -0.575 . . . . 0.0 110.793 178.734 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_exo -66.79 149.33 83.48 Favored 'Trans proline' 0 N--CA 1.496 1.629 0 C-N-CA 122.589 2.193 . . . . 0.0 112.292 178.792 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.46 HG23 ' N ' ' A' ' 50' ' ' THR . 5.0 m -64.57 -39.73 86.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.815 0.817 . . . . 0.0 110.695 179.193 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.46 ' N ' HG23 ' A' ' 49' ' ' VAL . 8.5 m -56.34 -66.08 0.5 Allowed 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 114.738 -1.119 . . . . 0.0 110.548 179.316 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -50.43 -39.24 46.97 Favored 'General case' 0 C--O 1.24 0.559 0 CA-C-O 121.441 0.639 . . . . 0.0 109.645 -179.204 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.57 HD23 ' O ' ' A' ' 52' ' ' LEU . 1.4 tt -59.55 -42.17 91.77 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.859 -0.61 . . . . 0.0 109.433 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.533 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -65.0 -42.87 94.11 Favored 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 120.863 -0.335 . . . . 0.0 110.135 179.591 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 83.6 tt0 -53.62 -34.23 57.79 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 179.901 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -72.13 -38.87 69.17 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.582 178.971 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 96.8 mt -88.41 -68.95 0.62 Allowed 'Isoleucine or valine' 0 CA--C 1.521 -0.173 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.244 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' GLY . . . . . 0.533 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 148.94 71.25 0.01 OUTLIER Glycine 0 CA--C 1.521 0.451 0 N-CA-C 111.682 -0.567 . . . . 0.0 111.682 179.617 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 4.1 mmt 57.83 79.15 0.21 Allowed 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 120.779 0.323 . . . . 0.0 110.641 179.35 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 86.4 mt-10 -150.91 19.93 0.78 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.729 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -61.77 -30.64 70.93 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.411 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 36.0 t -65.26 -42.94 92.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.524 -179.8 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.53 -30.88 71.62 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.082 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 89.8 t -70.49 -49.91 49.39 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.209 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.566 179.436 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 38.8 t -57.06 -42.56 80.79 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 120.892 0.377 . . . . 0.0 110.249 -179.787 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 43.5 t60 -60.91 -50.6 72.76 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-O 121.259 0.552 . . . . 0.0 110.499 179.777 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' GLN . . . . . 0.603 HE22 HD12 ' A' ' 38' ' ' ILE . 37.0 mt-30 -62.32 -34.54 76.82 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.069 179.646 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.483 HD21 HH21 ' A' ' 71' ' ' ARG . 2.4 tp -62.91 -43.68 98.14 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.223 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 95.5 mtt-85 -62.57 -41.56 99.0 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 120.849 0.356 . . . . 0.0 110.186 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 86.2 t -63.1 -53.84 41.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.199 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 12.5 mt -61.13 -40.85 95.35 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.027 0.441 . . . . 0.0 110.048 -179.485 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.483 HH21 HD21 ' A' ' 67' ' ' LEU . 62.2 ttm-85 -54.83 -41.01 70.16 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.941 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 -60.14 -48.18 82.81 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 120.396 -0.522 . . . . 0.0 110.495 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.4 mt -66.87 -41.47 87.21 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.936 0.398 . . . . 0.0 110.555 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 100.41 88.99 2.02 Favored Glycine 0 CA--C 1.52 0.389 0 N-CA-C 110.947 -0.861 . . . . 0.0 110.947 -179.775 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 5.1 tp -152.2 -14.17 0.18 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.749 0.309 . . . . 0.0 110.853 179.834 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.434 ' HA ' ' H ' ' A' ' 90' ' ' TYR . 28.1 m -134.96 158.64 41.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.066 -179.701 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.681 HG12 ' N ' ' A' ' 78' ' ' GLY . 59.4 t -124.07 170.98 13.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.276 -179.635 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' GLY . . . . . 0.681 ' N ' HG12 ' A' ' 77' ' ' VAL . . . -158.53 149.13 19.17 Favored Glycine 0 CA--C 1.526 0.733 0 N-CA-C 110.604 -0.998 . . . . 0.0 110.604 179.386 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 62.7 t0 . . . . . 0 N--CA 1.467 0.388 0 CA-C-O 120.905 0.383 . . . . 0.0 110.447 -179.911 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 52.2 t . . . . . 0 N--CA 1.465 0.303 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.583 ' N ' ' CD1' ' A' ' 87' ' ' TYR . 0.2 OUTLIER -112.25 136.06 52.15 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.063 -179.815 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 1.9 m -150.92 171.66 16.9 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.805 -0.442 . . . . 0.0 109.805 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 34.0 mt -84.28 143.31 29.63 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.616 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.434 ' H ' ' HA ' ' A' ' 76' ' ' VAL . 77.5 t80 -60.42 -45.67 92.79 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.689 179.665 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 35.7 p30 -141.98 171.5 13.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.507 -179.893 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' THR . . . . . 0.486 ' O ' ' HB3' ' A' ' 95' ' ' ALA . 54.9 p -96.83 -7.23 34.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.564 -179.854 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 93' ' ' HIS . . . . . 0.606 ' CG ' ' CE1' ' B' ' 223' ' ' HIS . 61.4 m80 -41.85 -61.45 1.11 Allowed 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.033 0.444 . . . . 0.0 110.637 179.734 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 69.1 t -53.88 -41.04 47.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.788 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.486 ' HB3' ' O ' ' A' ' 92' ' ' THR . . . -56.84 -43.51 81.17 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.346 179.79 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 90.6 mt-30 -62.27 -45.4 93.46 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 121.153 0.502 . . . . 0.0 110.132 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 13.6 tp -56.84 -44.38 82.04 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.007 -179.332 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 92.9 mt -64.13 -37.12 86.3 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.01 179.546 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 46.3 t0 -56.47 -45.62 80.8 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.107 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.463 ' OE2' ' OE2' ' B' ' 219' ' ' GLU . 91.7 mt-10 -67.52 -52.09 43.16 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.604 179.382 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -52.74 -46.39 67.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.057 179.782 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 5.2 mm -63.39 -44.25 98.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 121.132 0.491 . . . . 0.0 110.71 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -60.65 -46.19 91.26 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.254 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' HIS . . . . . 0.61 ' CE1' ' CG ' ' B' ' 212' ' ' HIS . 68.2 t60 -65.29 -36.81 85.21 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.465 179.733 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 47.2 t -59.48 -46.59 88.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.333 -179.772 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 77.9 tt0 -74.7 -60.55 2.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.075 0.464 . . . . 0.0 110.807 179.333 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 85.6 t60 . . . . . 0 CA--C 1.515 -0.375 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.913 -179.574 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 135' ' ' ASP . . . . . 0.52 ' O ' ' N ' ' B' ' 138' ' ' ALA . 97.9 m-20 . . . . . 0 CA--C 1.523 -0.061 0 CA-C-O 120.474 0.178 . . . . 0.0 110.631 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 92.8 p -38.43 -40.08 0.52 Allowed 'General case' 0 C--O 1.236 0.352 0 CA-C-O 121.27 0.557 . . . . 0.0 110.403 -179.71 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 95.9 mm-40 -65.66 -43.27 89.91 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.172 179.175 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 138' ' ' ALA . . . . . 0.52 ' N ' ' O ' ' B' ' 135' ' ' ASP . . . -64.81 -29.1 70.05 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.489 179.44 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.83 -52.43 30.02 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.338 179.734 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -60.47 -50.14 74.76 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.929 0.395 . . . . 0.0 111.172 179.592 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 68.1 tp60 -53.92 -49.55 68.4 Favored 'General case' 0 C--O 1.243 0.72 0 CA-C-O 121.591 0.71 . . . . 0.0 110.019 -179.576 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 142' ' ' VAL . . . . . 0.432 HG23 ' O ' ' B' ' 138' ' ' ALA . 53.4 t -62.21 -42.71 96.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.784 179.38 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 143' ' ' ALA . . . . . 0.438 ' HB2' HD12 ' A' ' 36' ' ' LEU . . . -50.24 -46.76 55.07 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.011 179.648 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 11.3 t -59.99 -44.51 94.48 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.155 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 19.8 m -63.75 -51.36 65.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.265 0.555 . . . . 0.0 111.049 179.909 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 92.5 mt -67.75 -21.1 65.29 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.909 -179.572 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 147' ' ' GLN . . . . . 0.41 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 53.2 tt0 -75.34 -59.37 2.77 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.728 179.417 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 148' ' ' ALA . . . . . 0.486 ' HB1' ' NH1' ' B' ' 154' ' ' ARG . . . -59.02 -53.69 55.56 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.049 -179.159 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.441 ' O ' ' C ' ' B' ' 150' ' ' ALA . 4.0 mm? -50.86 -41.95 58.37 Favored 'General case' 0 CA--C 1.509 -0.599 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 -178.304 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 150' ' ' ALA . . . . . 0.553 ' O ' ' C ' ' B' ' 151' ' ' THR . . . -38.91 -72.18 0.07 Allowed 'General case' 0 CA--C 1.511 -0.555 0 O-C-N 123.519 0.512 . . . . 0.0 110.334 179.719 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 151' ' ' THR . . . . . 0.553 ' C ' ' O ' ' B' ' 150' ' ' ALA . 6.5 p -1.77 105.74 0.02 OUTLIER Pre-proline 0 N--CA 1.478 0.948 0 O-C-N 124.428 1.08 . . . . 0.0 111.088 -179.839 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo -46.32 -48.73 12.77 Favored 'Trans proline' 0 C--N 1.307 -1.648 0 C-N-CA 122.053 1.836 . . . . 0.0 113.154 -177.574 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 11.3 t -57.2 -43.99 83.22 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.722 -179.214 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 154' ' ' ARG . . . . . 0.486 ' NH1' ' HB1' ' B' ' 148' ' ' ALA . 38.7 ttm180 -62.42 -43.86 97.82 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.592 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 155' ' ' LEU . . . . . 0.518 ' O ' HG23 ' B' ' 159' ' ' THR . 31.5 mt -58.4 -51.5 69.57 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.424 -0.511 . . . . 0.0 110.718 -179.561 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 156' ' ' MET . . . . . 0.401 ' O ' ' OG1' ' B' ' 159' ' ' THR . 51.9 ttp -55.44 -45.65 76.81 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 120.267 -0.573 . . . . 0.0 110.596 179.727 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 97.0 mt -62.65 -47.4 93.08 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 CA-C-O 121.378 0.609 . . . . 0.0 110.87 -179.514 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -62.53 -41.31 98.79 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.602 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 159' ' ' THR . . . . . 0.518 HG23 ' O ' ' B' ' 155' ' ' LEU . 31.3 p -62.47 -32.77 73.71 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.064 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 59.2 tp60 -64.93 -50.17 67.51 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.223 -0.444 . . . . 0.0 109.949 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 161' ' ' LEU . . . . . 0.429 ' O ' ' N ' ' B' ' 164' ' ' GLY . 17.0 mt -62.49 -31.75 72.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.584 179.776 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 162' ' ' ARG . . . . . . . . . . . . . 11.2 ttm180 -40.82 -41.47 1.58 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.618 -179.625 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -62.33 -42.25 99.23 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.316 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 164' ' ' GLY . . . . . 0.429 ' N ' ' O ' ' B' ' 161' ' ' LEU . . . 161.03 178.58 35.13 Favored Glycine 0 CA--C 1.527 0.785 0 C-N-CA 120.672 -0.775 . . . . 0.0 111.331 179.086 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_exo -67.74 147.94 76.44 Favored 'Trans proline' 0 N--CA 1.49 1.272 0 C-N-CA 122.836 2.357 . . . . 0.0 112.028 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 166' ' ' LEU . . . . . 0.577 ' O ' HD12 ' B' ' 166' ' ' LEU . 0.3 OUTLIER -163.76 160.61 17.36 Favored Pre-proline 0 CA--C 1.534 0.359 0 C-N-CA 120.133 -0.627 . . . . 0.0 110.701 178.717 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 16.1 Cg_exo -68.22 149.33 75.98 Favored 'Trans proline' 0 N--CA 1.495 1.583 0 C-N-CA 122.525 2.15 . . . . 0.0 112.119 178.821 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 168' ' ' VAL . . . . . 0.456 HG23 ' N ' ' B' ' 169' ' ' THR . 4.5 m -64.54 -40.0 87.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 121.819 0.818 . . . . 0.0 110.728 179.143 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 169' ' ' THR . . . . . 0.456 ' N ' HG23 ' B' ' 168' ' ' VAL . 7.0 m -55.87 -66.5 0.41 Allowed 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 114.702 -1.135 . . . . 0.0 110.496 179.381 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 93.2 m-20 -50.35 -39.91 47.65 Favored 'General case' 0 C--O 1.239 0.546 0 CA-C-O 121.326 0.584 . . . . 0.0 109.687 -179.341 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 171' ' ' LEU . . . . . 0.596 HD23 ' O ' ' B' ' 171' ' ' LEU . 1.5 tt -58.99 -42.5 90.18 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.379 -0.601 . . . . 0.0 109.379 -179.838 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 172' ' ' ALA . . . . . 0.539 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -64.37 -42.63 96.08 Favored 'General case' 0 N--CA 1.446 -0.675 0 C-N-CA 120.826 -0.35 . . . . 0.0 110.18 179.575 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -53.92 -34.51 59.78 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.099 -0.5 . . . . 0.0 109.695 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -71.97 -38.22 69.77 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.574 178.916 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 96.7 mt -88.55 -69.43 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.519 -0.246 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.296 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 176' ' ' GLY . . . . . 0.539 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 148.98 70.43 0.01 OUTLIER Glycine 0 CA--C 1.522 0.5 0 N-CA-C 111.518 -0.633 . . . . 0.0 111.518 179.654 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 3.9 mmt 58.71 78.46 0.25 Allowed 'General case' 0 N--CA 1.462 0.148 0 CA-C-O 120.782 0.325 . . . . 0.0 110.807 179.282 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 86.3 mt-10 -150.55 20.15 0.82 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.8 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -61.69 -29.96 70.43 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.056 0.455 . . . . 0.0 110.29 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 6.9 t -65.57 -43.38 89.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.529 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -62.31 -30.81 71.41 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.177 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 83.9 t -71.0 -50.36 43.17 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.185 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.591 179.497 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 42.9 t -57.37 -41.74 80.74 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.928 0.394 . . . . 0.0 110.336 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 19.5 t60 -61.64 -51.0 70.27 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.212 0.53 . . . . 0.0 110.51 179.835 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 36.4 mt-30 -62.65 -32.81 73.92 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.015 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 186' ' ' LEU . . . . . 0.436 HD21 HH21 ' B' ' 190' ' ' ARG . 2.7 tp -63.27 -44.12 96.02 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.1 179.876 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -62.63 -41.88 99.28 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 120.729 -0.388 . . . . 0.0 110.31 -179.803 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 98.1 t -62.58 -54.13 38.0 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 C-N-CA 119.974 -0.69 . . . . 0.0 110.351 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 12.6 mt -60.73 -40.35 92.01 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.08 0.466 . . . . 0.0 110.049 -179.479 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 190' ' ' ARG . . . . . 0.436 HH21 HD21 ' B' ' 186' ' ' LEU . 62.7 ttm-85 -55.15 -41.68 72.12 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.025 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 92.1 m-20 -59.69 -46.82 87.92 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.439 -0.504 . . . . 0.0 110.281 -179.623 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 192' ' ' LEU . . . . . . . . . . . . . 9.7 mt -67.11 -39.75 86.74 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.953 0.406 . . . . 0.0 110.417 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 97.54 88.79 1.88 Allowed Glycine 0 N--CA 1.463 0.474 0 N-CA-C 110.765 -0.934 . . . . 0.0 110.765 -179.651 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 4.7 tp -152.45 -13.64 0.17 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.802 0.334 . . . . 0.0 110.859 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 195' ' ' VAL . . . . . 0.429 ' HA ' ' H ' ' B' ' 209' ' ' TYR . 27.7 m -135.02 158.64 41.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 109.832 -0.432 . . . . 0.0 109.832 -179.697 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 196' ' ' VAL . . . . . 0.665 HG12 ' N ' ' B' ' 197' ' ' GLY . 64.7 t -121.8 169.02 13.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.323 -179.688 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 197' ' ' GLY . . . . . 0.665 ' N ' HG12 ' B' ' 196' ' ' VAL . . . -157.33 142.04 8.31 Favored Glycine 0 CA--C 1.525 0.665 0 N-CA-C 110.615 -0.994 . . . . 0.0 110.615 179.471 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 60.4 t0 . . . . . 0 N--CA 1.467 0.411 0 CA-C-O 120.935 0.398 . . . . 0.0 110.559 179.989 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 55.6 t . . . . . 0 N--CA 1.466 0.367 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 206' ' ' TYR . . . . . 0.593 ' N ' ' CD1' ' B' ' 206' ' ' TYR . 0.2 OUTLIER -108.43 135.9 48.94 Favored 'General case' 0 N--CA 1.469 0.485 0 O-C-N 123.58 0.55 . . . . 0.0 109.987 -179.834 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 3.1 m -150.63 171.16 17.57 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 -179.834 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . 29.5 mt -83.77 143.13 30.19 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.623 -179.812 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 209' ' ' TYR . . . . . 0.442 ' HA ' HG23 ' B' ' 196' ' ' VAL . 81.0 t80 -60.69 -46.02 91.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.71 179.77 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 43.2 p30 -140.84 172.56 12.52 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.338 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 211' ' ' THR . . . . . 0.472 ' O ' ' HB3' ' B' ' 214' ' ' ALA . 43.5 p -98.37 -7.65 28.42 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.439 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 212' ' ' HIS . . . . . 0.61 ' CG ' ' CE1' ' A' ' 104' ' ' HIS . 60.5 m80 -41.7 -61.33 1.11 Allowed 'General case' 0 C--O 1.233 0.224 0 CA-C-O 120.96 0.41 . . . . 0.0 110.419 179.779 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 92.0 t -53.88 -41.64 49.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.181 -0.463 . . . . 0.0 109.771 -179.743 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 214' ' ' ALA . . . . . 0.472 ' HB3' ' O ' ' B' ' 211' ' ' THR . . . -56.44 -43.37 79.43 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.368 179.814 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 84.3 mt-30 -62.38 -45.26 93.97 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.072 -179.813 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 216' ' ' LEU . . . . . . . . . . . . . 12.6 tp -56.61 -44.38 81.1 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.509 -0.477 . . . . 0.0 109.898 -179.326 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 92.5 mt -63.8 -38.23 90.32 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.093 179.522 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 58.0 t0 -56.05 -45.84 79.09 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.08 -179.71 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 219' ' ' GLU . . . . . 0.463 ' OE2' ' OE2' ' A' ' 100' ' ' GLU . 93.6 mt-10 -67.66 -51.79 45.67 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.708 -0.397 . . . . 0.0 110.62 179.462 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -53.09 -46.32 68.59 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 179.861 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 4.8 mm -63.73 -44.08 98.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 121.084 0.469 . . . . 0.0 110.613 -179.746 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 84.5 t80 -60.58 -45.76 92.76 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.017 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 223' ' ' HIS . . . . . 0.606 ' CE1' ' CG ' ' A' ' 93' ' ' HIS . 68.5 t60 -65.55 -37.01 85.47 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.534 179.641 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 11.5 t -59.12 -46.73 87.58 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.339 -179.719 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -74.58 -59.8 2.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.09 0.472 . . . . 0.0 110.663 179.348 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 86.1 t60 . . . . . 0 CA--C 1.514 -0.435 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.877 -179.576 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 95.4 m-20 . . . . . 0 CA--C 1.528 0.111 0 CA-C-O 120.696 0.284 . . . . 0.0 110.737 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 12.4 t -45.02 -48.17 11.6 Favored 'General case' 0 C--O 1.239 0.549 0 CA-C-O 121.164 0.507 . . . . 0.0 110.142 179.488 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 9.4 mp0 -64.53 -45.53 86.75 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.125 -0.488 . . . . 0.0 109.895 179.461 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.643 ' O ' HG23 ' A' ' 23' ' ' VAL . . . -56.14 -28.4 57.85 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.189 -0.46 . . . . 0.0 109.872 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.475 ' HB1' ' HB3' ' B' ' 155' ' ' LEU . . . -71.98 -49.54 36.4 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 110.108 -0.33 . . . . 0.0 110.108 179.429 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.03 -44.96 96.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.354 -179.803 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -60.96 -51.62 68.5 Favored 'General case' 0 C--O 1.242 0.671 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.701 -179.507 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.643 HG23 ' O ' ' A' ' 19' ' ' ALA . 98.8 t -60.49 -44.28 96.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.967 179.744 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.69 -42.14 78.56 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 120.804 -0.358 . . . . 0.0 110.201 179.525 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.2 m -59.2 -43.86 92.23 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.309 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.475 ' OG1' ' O ' ' A' ' 23' ' ' VAL . 30.6 p -64.83 -52.24 57.78 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 120.833 -0.347 . . . . 0.0 110.635 179.872 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.414 ' N ' ' CD1' ' A' ' 27' ' ' LEU . 7.6 mp -63.17 -21.58 66.3 Favored 'General case' 0 C--O 1.223 -0.295 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.787 179.493 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.553 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 64.0 tt0 -74.31 -59.91 2.51 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.688 179.391 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.62 -54.63 44.88 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.518 -179.478 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.505 ' O ' ' O ' ' A' ' 31' ' ' ALA . 8.5 mp -47.79 -32.42 5.99 Favored 'General case' 0 CA--C 1.515 -0.393 0 C-N-CA 120.956 -0.298 . . . . 0.0 110.387 -179.947 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.553 ' HB3' ' O ' ' A' ' 28' ' ' GLN . . . -56.84 -139.04 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.459 0 O-C-N 123.51 0.506 . . . . 0.0 110.247 179.711 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.485 ' O ' ' O ' ' A' ' 31' ' ' ALA . 7.1 m 56.54 117.35 0.01 OUTLIER Pre-proline 0 C--N 1.32 -0.695 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.347 179.659 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -48.37 -47.83 18.89 Favored 'Trans proline' 0 C--N 1.308 -1.561 0 C-N-CA 122.311 2.008 . . . . 0.0 112.824 -178.85 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 77.8 p -58.15 -48.71 79.42 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.977 -178.467 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.1 mmp_? -68.15 -36.58 79.9 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.584 179.893 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.518 HD13 ' O ' ' A' ' 36' ' ' LEU . 0.2 OUTLIER -61.34 -53.45 56.55 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.468 -0.493 . . . . 0.0 110.687 -178.367 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.453 ' C ' ' SD ' ' A' ' 37' ' ' MET . 0.9 OUTLIER -60.73 -45.77 93.0 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.473 179.967 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 86.8 mt -61.18 -43.56 96.62 Favored 'Isoleucine or valine' 0 C--O 1.242 0.66 0 CA-C-O 121.258 0.552 . . . . 0.0 110.394 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 34.5 mt -62.06 -40.59 96.29 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.519 179.859 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 99.0 m -59.92 -42.25 93.53 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.912 179.703 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 51.1 mt-30 -58.23 -44.12 88.08 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.132 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.536 HD22 ' O ' ' A' ' 87' ' ' TYR . 19.4 mt -63.79 -42.92 97.65 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.897 178.919 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.518 HH12 ' C ' ' A' ' 98' ' ' LEU . 59.0 ttp180 -62.69 -35.88 81.12 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.323 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 14.3 t-20 -57.82 -41.42 82.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.607 -178.888 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 163.36 -175.96 39.58 Favored Glycine 0 CA--C 1.526 0.762 0 N-CA-C 110.972 -0.851 . . . . 0.0 110.972 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -74.58 135.03 19.35 Favored 'Trans proline' 0 N--CA 1.495 1.603 0 C-N-CA 122.812 2.341 . . . . 0.0 112.075 -179.533 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -157.02 98.82 2.01 Favored Pre-proline 0 CA--C 1.54 0.585 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.265 -178.833 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_exo -47.12 165.05 0.1 Allowed 'Trans proline' 0 C--N 1.301 -1.934 0 C-N-CA 122.321 2.014 . . . . 0.0 112.554 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 75.1 t -48.6 -43.48 13.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.693 -179.776 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 47.3 p -61.25 -39.86 91.91 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.504 179.569 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -64.71 -38.2 90.2 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.003 179.769 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.617 ' O ' HD13 ' A' ' 52' ' ' LEU . 0.2 OUTLIER -62.5 -46.84 86.62 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 120.42 -0.512 . . . . 0.0 110.223 179.811 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.525 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -55.18 -47.2 75.56 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.657 179.558 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 48.9 tp10 -55.38 -50.41 69.78 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.168 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.08 -58.22 7.21 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.767 -179.657 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 98.4 mt -85.7 -73.69 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.444 179.786 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' GLY . . . . . 0.525 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 131.62 94.51 0.63 Allowed Glycine 0 N--CA 1.461 0.358 0 N-CA-C 111.163 -0.775 . . . . 0.0 111.163 179.695 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 84.6 mmm 67.54 84.27 0.16 Allowed 'General case' 0 CA--C 1.521 -0.161 0 CA-C-O 120.829 0.347 . . . . 0.0 111.025 178.593 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 15.2 tt0 -169.32 28.15 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.275 179.588 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 22.0 mt-30 -66.45 -23.83 66.34 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.78 -179.335 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 15.5 t -66.06 -44.46 84.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.132 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.531 ' O ' ' NE2' ' A' ' 66' ' ' GLN . . . -63.4 -31.98 73.28 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.327 -179.695 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 60.2 t -72.6 -53.81 18.04 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.242 0 C-N-CA 120.746 -0.382 . . . . 0.0 110.647 -179.457 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 79.7 p -58.13 -40.3 80.94 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.909 -0.317 . . . . 0.0 110.165 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' HIS . . . . . 0.41 ' ND1' ' OE1' ' A' ' 66' ' ' GLN . 50.4 t-80 -65.86 -51.21 60.74 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.087 0.47 . . . . 0.0 110.845 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' GLN . . . . . 0.531 ' NE2' ' O ' ' A' ' 62' ' ' ALA . 0.7 OUTLIER -61.9 -39.55 92.35 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.287 179.765 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.497 HD21 ' CE1' ' A' ' 87' ' ' TYR . 23.6 tp -61.8 -44.3 97.14 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.236 -179.49 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 21.0 mmt85 -61.67 -41.64 97.83 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 120.795 0.331 . . . . 0.0 110.516 -179.376 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.404 HG23 ' O ' ' A' ' 65' ' ' HIS . 94.0 t -61.2 -55.01 27.48 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.222 0 C-N-CA 120.224 -0.59 . . . . 0.0 110.262 -179.522 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 10.5 mp -62.0 -39.57 92.68 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 179.392 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 78.1 ttt-85 -51.96 -42.67 63.07 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.003 -179.552 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -60.63 -45.57 93.54 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.638 -0.425 . . . . 0.0 110.25 179.873 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.8 mt -65.84 -38.71 89.59 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.134 179.817 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 91.33 32.75 8.53 Favored Glycine 0 CA--C 1.522 0.522 0 N-CA-C 110.905 -0.878 . . . . 0.0 110.905 -179.534 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 91.2 mt -95.85 -1.33 49.71 Favored 'General case' 0 CA--C 1.519 -0.232 0 O-C-N 122.86 -0.2 . . . . 0.0 110.597 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.402 ' HA ' ' H ' ' A' ' 90' ' ' TYR . 26.8 m -134.28 155.97 39.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.191 -179.877 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 73.0 t -124.95 137.61 56.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.146 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -119.89 129.87 8.17 Favored Glycine 0 N--CA 1.465 0.589 0 N-CA-C 110.734 -0.946 . . . . 0.0 110.734 179.353 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 12.9 t70 . . . . . 0 N--CA 1.465 0.319 0 N-CA-C 110.304 -0.258 . . . . 0.0 110.304 -179.8 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 99.5 t . . . . . 0 N--CA 1.463 0.217 0 CA-C-O 120.956 0.407 . . . . 0.0 110.577 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.536 ' O ' HD22 ' A' ' 42' ' ' LEU . 65.4 m-85 -98.62 125.2 43.81 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.133 179.768 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 86.7 p -142.24 160.62 39.89 Favored 'General case' 0 C--O 1.224 -0.271 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.438 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 7.3 mt -72.73 136.69 45.57 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.633 -179.849 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.468 ' CD1' ' C ' ' A' ' 90' ' ' TYR . 20.8 t80 -62.59 -51.52 67.0 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.743 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.5 m-20 -83.58 143.06 30.4 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.526 -179.409 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 98.9 m -94.21 -25.82 16.92 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.357 179.091 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' HIS . . . . . 0.62 ' CG ' ' ND1' ' B' ' 223' ' ' HIS . 71.1 m80 -58.23 -44.04 88.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.363 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.531 HG23 ' N ' ' A' ' 95' ' ' ALA . 20.0 m -56.04 -42.01 70.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.021 -179.862 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.531 ' N ' HG23 ' A' ' 94' ' ' VAL . . . -60.88 -45.97 92.46 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.997 0.427 . . . . 0.0 110.28 179.035 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 67.1 tp60 -62.04 -41.52 98.21 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.106 179.34 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.423 HD11 ' HG ' ' B' ' 216' ' ' LEU . 11.3 tp -58.56 -44.4 89.7 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.22 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.518 ' C ' HH12 ' A' ' 43' ' ' ARG . 87.1 mt -63.24 -39.54 94.91 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.227 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' ASP . . . . . 0.494 ' N ' ' NH1' ' A' ' 43' ' ' ARG . 52.1 m-20 -59.36 -41.24 88.82 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.747 0.308 . . . . 0.0 110.527 -179.481 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -69.53 -54.41 14.28 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.993 179.456 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.12 -43.23 91.94 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.443 -179.857 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.401 ' CG1' ' O ' ' A' ' 98' ' ' LEU . 4.1 mm -61.68 -45.54 98.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.328 -179.283 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 87.7 t80 -60.2 -39.7 87.47 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.865 0.365 . . . . 0.0 110.275 179.594 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' HIS . . . . . 0.574 ' ND1' ' CG ' ' B' ' 212' ' ' HIS . 57.6 t60 -63.76 -39.34 94.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.747 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 29.8 t -75.7 -42.8 49.91 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.895 179.744 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 11.6 tm-20 -60.08 -37.86 81.17 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.495 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 82.2 t60 . . . . . 0 CA--C 1.508 -0.647 0 CA-C-N 116.114 -0.493 . . . . 0.0 109.887 -179.048 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 94.3 m-20 . . . . . 0 N--CA 1.462 0.172 0 CA-C-O 120.797 0.332 . . . . 0.0 110.646 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 44.1 t -44.32 -49.31 9.53 Favored 'General case' 0 C--O 1.241 0.622 0 CA-C-O 121.088 0.47 . . . . 0.0 110.356 179.265 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 9.5 mp0 -64.19 -45.29 88.99 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.058 179.543 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 138' ' ' ALA . . . . . 0.631 ' O ' HG23 ' B' ' 142' ' ' VAL . . . -56.3 -28.65 59.49 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.189 -0.459 . . . . 0.0 109.872 179.849 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -71.66 -49.93 35.24 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 179.569 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -60.74 -45.48 94.12 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.338 -179.876 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -60.44 -51.56 68.94 Favored 'General case' 0 C--O 1.24 0.583 0 CA-C-O 121.134 0.492 . . . . 0.0 110.652 -179.361 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 142' ' ' VAL . . . . . 0.631 HG23 ' O ' ' B' ' 138' ' ' ALA . 95.1 t -60.42 -44.24 95.76 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.308 0 CA-C-N 115.888 -0.597 . . . . 0.0 109.993 179.786 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -56.86 -42.13 79.19 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.733 0.301 . . . . 0.0 110.274 179.69 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 70.4 m -59.08 -44.38 91.88 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.377 -179.838 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 145' ' ' THR . . . . . 0.48 ' OG1' ' O ' ' B' ' 142' ' ' VAL . 35.4 p -64.33 -51.37 63.73 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.702 179.753 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 146' ' ' LEU . . . . . 0.403 ' N ' ' CD1' ' B' ' 146' ' ' LEU . 7.6 mp -63.68 -21.51 66.42 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.805 179.502 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 147' ' ' GLN . . . . . 0.568 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 57.7 tt0 -74.68 -59.59 2.66 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.709 179.418 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -58.33 -54.77 43.2 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.685 -179.476 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.478 ' O ' ' O ' ' B' ' 150' ' ' ALA . 8.7 mp -48.42 -30.57 5.19 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.914 -0.314 . . . . 0.0 110.392 -179.891 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 150' ' ' ALA . . . . . 0.568 ' HB3' ' O ' ' B' ' 147' ' ' GLN . . . -58.08 -138.33 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.456 0 O-C-N 123.611 0.569 . . . . 0.0 110.144 179.702 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 151' ' ' THR . . . . . 0.482 ' O ' ' O ' ' B' ' 150' ' ' ALA . 27.2 m 56.1 117.37 0.01 OUTLIER Pre-proline 0 C--N 1.323 -0.557 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.438 179.636 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -48.25 -47.83 18.61 Favored 'Trans proline' 0 C--N 1.307 -1.624 0 C-N-CA 122.281 1.988 . . . . 0.0 112.901 -179.115 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 77.4 p -58.18 -48.92 78.81 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.933 -178.435 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 154' ' ' ARG . . . . . 0.412 HH21 HG21 ' B' ' 157' ' ' ILE . 1.1 mmp_? -67.39 -37.04 82.51 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.598 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 155' ' ' LEU . . . . . 0.515 ' O ' HD13 ' B' ' 155' ' ' LEU . 0.2 OUTLIER -60.24 -53.19 60.63 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.399 -0.52 . . . . 0.0 110.714 -178.347 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 156' ' ' MET . . . . . 0.457 ' C ' ' SD ' ' B' ' 156' ' ' MET . 1.0 OUTLIER -61.15 -45.65 93.77 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.452 179.981 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 157' ' ' ILE . . . . . 0.412 HG21 HH21 ' B' ' 154' ' ' ARG . 92.6 mt -60.93 -43.75 96.51 Favored 'Isoleucine or valine' 0 C--O 1.242 0.667 0 CA-C-O 121.227 0.537 . . . . 0.0 110.434 -179.616 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 17.0 mt -62.29 -40.13 95.27 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.395 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 19.7 m -59.87 -43.2 94.84 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.158 179.551 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 56.8 mt-30 -57.9 -44.25 86.64 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.077 179.72 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 161' ' ' LEU . . . . . 0.53 HD22 ' O ' ' B' ' 206' ' ' TYR . 20.0 mt -63.95 -42.89 97.17 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.915 179.02 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 162' ' ' ARG . . . . . 0.53 HH12 ' C ' ' B' ' 217' ' ' LEU . 58.7 ttp180 -62.9 -35.45 80.09 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.253 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 17.1 t-20 -58.19 -44.61 88.16 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.747 -178.649 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . 167.46 -174.86 42.6 Favored Glycine 0 CA--C 1.526 0.777 0 N-CA-C 110.989 -0.844 . . . . 0.0 110.989 179.788 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -75.51 133.23 15.61 Favored 'Trans proline' 0 N--CA 1.494 1.543 0 C-N-CA 122.839 2.359 . . . . 0.0 111.997 -179.728 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -155.41 99.08 2.3 Favored Pre-proline 0 CA--C 1.539 0.555 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.275 -178.882 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_exo -47.56 165.28 0.12 Allowed 'Trans proline' 0 C--N 1.3 -2.015 0 C-N-CA 122.45 2.1 . . . . 0.0 112.411 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . 87.5 t -48.75 -43.4 14.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.68 -179.683 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 169' ' ' THR . . . . . . . . . . . . . 63.4 p -61.45 -39.52 91.14 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.446 179.613 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.83 -38.63 91.64 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.151 179.516 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 171' ' ' LEU . . . . . 0.607 ' O ' HD13 ' B' ' 171' ' ' LEU . 0.2 OUTLIER -62.29 -46.56 88.21 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 120.309 -0.556 . . . . 0.0 110.149 179.771 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 172' ' ' ALA . . . . . 0.55 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -55.45 -47.18 76.46 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 179.435 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 43.8 tp10 -55.43 -50.56 69.48 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.424 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -52.0 -57.22 10.12 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 120.81 -0.356 . . . . 0.0 110.774 -179.592 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 175' ' ' ILE . . . . . 0.452 HD13 ' OE1' ' B' ' 178' ' ' GLU . 99.1 mt -87.1 -70.99 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.522 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 176' ' ' GLY . . . . . 0.55 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 128.14 94.36 0.81 Allowed Glycine 0 N--CA 1.461 0.357 0 N-CA-C 111.136 -0.786 . . . . 0.0 111.136 179.696 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 83.8 mmm 68.96 86.46 0.13 Allowed 'General case' 0 C--N 1.34 0.189 0 C-N-CA 120.899 -0.32 . . . . 0.0 110.981 178.388 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 178' ' ' GLU . . . . . 0.46 ' HG2' ' HB3' ' B' ' 181' ' ' ALA . 47.3 tt0 -172.53 28.01 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.193 179.306 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 22.4 mt-30 -66.75 -23.8 66.13 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.762 -179.531 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 11.9 t -66.53 -44.12 83.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.028 -179.721 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 181' ' ' ALA . . . . . 0.522 ' O ' ' NE2' ' B' ' 185' ' ' GLN . . . -63.7 -32.39 73.86 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.482 -179.765 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 65.0 t -71.94 -53.56 19.73 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 C-N-CA 120.664 -0.414 . . . . 0.0 110.655 -179.314 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 77.5 p -58.36 -39.92 80.85 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.91 -0.316 . . . . 0.0 110.247 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 184' ' ' HIS . . . . . 0.4 ' ND1' ' OE1' ' B' ' 185' ' ' GLN . 49.6 t-80 -65.68 -51.11 62.0 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.714 179.897 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 185' ' ' GLN . . . . . 0.522 ' NE2' ' O ' ' B' ' 181' ' ' ALA . 0.8 OUTLIER -62.23 -40.62 96.73 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.36 179.835 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 186' ' ' LEU . . . . . 0.434 HD21 ' CE1' ' B' ' 206' ' ' TYR . 17.5 tp -60.67 -44.61 96.28 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.105 -179.651 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 21.5 mmt85 -60.99 -41.84 97.26 Favored 'General case' 0 C--O 1.24 0.563 0 CA-C-O 120.81 0.338 . . . . 0.0 110.546 -179.513 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 87.9 t -61.14 -54.93 28.51 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.177 0 C-N-CA 120.25 -0.58 . . . . 0.0 110.19 -179.517 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 10.5 mp -62.0 -39.68 93.08 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 110.152 -0.314 . . . . 0.0 110.152 179.399 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 77.1 ttt-85 -51.48 -42.9 61.96 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.03 -179.488 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 55.4 t30 -60.57 -45.57 93.43 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.461 179.725 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 192' ' ' LEU . . . . . . . . . . . . . 10.1 mt -65.26 -39.36 92.53 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.196 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 91.6 33.2 8.09 Favored Glycine 0 CA--C 1.524 0.61 0 N-CA-C 110.821 -0.912 . . . . 0.0 110.821 -179.62 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 77.8 mt -97.33 -0.74 45.94 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.513 0.197 . . . . 0.0 110.632 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 24.9 m -134.26 155.58 39.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.263 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 196' ' ' VAL . . . . . . . . . . . . . 76.1 t -125.57 138.98 52.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.128 -179.876 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 197' ' ' GLY . . . . . . . . . . . . . . . -121.65 130.66 8.19 Favored Glycine 0 N--CA 1.464 0.548 0 N-CA-C 110.823 -0.911 . . . . 0.0 110.823 179.697 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 13.1 t70 . . . . . 0 N--CA 1.465 0.287 0 N-CA-C 110.305 -0.257 . . . . 0.0 110.305 -179.813 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 89.5 t . . . . . 0 N--CA 1.462 0.17 0 CA-C-O 120.898 0.38 . . . . 0.0 110.609 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 206' ' ' TYR . . . . . 0.53 ' O ' HD22 ' B' ' 161' ' ' LEU . 68.6 m-85 -98.18 125.36 43.19 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.309 179.819 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 34.2 p -142.68 160.69 39.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.335 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . 6.0 mt -73.17 138.07 45.47 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.751 -179.82 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 209' ' ' TYR . . . . . 0.461 ' C ' ' CD1' ' B' ' 209' ' ' TYR . 22.3 t80 -63.46 -52.39 61.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.801 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 43.1 m-20 -82.7 142.5 31.61 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.474 -179.339 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 99.3 m -94.6 -24.06 17.37 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-O 121.068 0.461 . . . . 0.0 110.33 179.223 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 212' ' ' HIS . . . . . 0.574 ' CG ' ' ND1' ' A' ' 104' ' ' HIS . 72.2 m80 -59.5 -43.79 93.27 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.211 179.755 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 213' ' ' VAL . . . . . 0.554 HG23 ' N ' ' B' ' 214' ' ' ALA . 15.5 m -56.1 -42.77 73.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.021 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 214' ' ' ALA . . . . . 0.554 ' N ' HG23 ' B' ' 213' ' ' VAL . . . -59.9 -46.41 89.44 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.188 179.013 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 68.4 tp60 -61.36 -41.15 96.6 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.019 179.497 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 216' ' ' LEU . . . . . 0.423 ' HG ' HD11 ' A' ' 97' ' ' LEU . 10.0 tp -59.04 -43.99 91.71 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.268 -179.867 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 217' ' ' LEU . . . . . 0.53 ' C ' HH12 ' B' ' 162' ' ' ARG . 91.3 mt -63.51 -38.96 93.14 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.229 179.709 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 218' ' ' ASP . . . . . 0.478 ' N ' ' NH1' ' B' ' 162' ' ' ARG . 69.3 m-20 -59.66 -41.55 90.84 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.889 0.376 . . . . 0.0 110.603 -179.52 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 219' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -69.52 -54.92 11.81 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.984 179.581 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -58.15 -43.76 87.55 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.4 -179.686 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 221' ' ' ILE . . . . . 0.414 ' CG1' ' O ' ' B' ' 217' ' ' LEU . 4.1 mm -61.47 -45.91 97.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.388 -178.987 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 86.5 t80 -60.94 -40.14 92.13 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.244 179.757 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 223' ' ' HIS . . . . . 0.62 ' ND1' ' CG ' ' A' ' 93' ' ' HIS . 41.4 t60 -61.5 -41.92 98.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.032 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 35.6 t -73.63 -40.79 63.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.013 179.905 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 11.4 tm-20 -65.29 -31.38 72.49 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.708 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 226' ' ' HIS . . . . . 0.51 ' CG ' ' O ' ' B' ' 226' ' ' HIS . 52.1 t-80 . . . . . 0 C--N 1.325 -0.457 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.689 -179.52 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 93.7 m-20 . . . . . 0 C--O 1.224 -0.267 0 CA-C-O 120.46 0.171 . . . . 0.0 110.7 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 47.6 t -38.74 -49.91 1.62 Allowed 'General case' 0 C--O 1.239 0.518 0 CA-C-O 121.383 0.611 . . . . 0.0 110.606 -179.661 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.408 ' HG2' ' H ' ' A' ' 18' ' ' GLN . 3.0 pt20 -64.64 -46.43 82.57 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.003 179.319 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.632 ' O ' HG23 ' A' ' 23' ' ' VAL . . . -58.43 -28.65 65.46 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.221 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.464 ' HB1' ' HB3' ' B' ' 155' ' ' LEU . . . -70.97 -51.0 28.23 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 120.888 0.375 . . . . 0.0 110.128 179.834 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.49 -40.53 96.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.557 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -62.31 -50.43 71.67 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-O 121.417 0.627 . . . . 0.0 110.444 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.632 HG23 ' O ' ' A' ' 19' ' ' ALA . 93.9 t -61.74 -43.36 97.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.98 179.712 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.71 -41.4 81.67 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 58.9 m -59.47 -45.25 92.16 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.154 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.438 ' OG1' ' O ' ' A' ' 23' ' ' VAL . 22.6 p -63.99 -44.58 92.26 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-O 120.937 0.398 . . . . 0.0 110.442 179.551 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 95.9 mt -67.13 -21.73 65.83 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.332 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.49 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 60.1 tt0 -74.49 -58.18 3.45 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.274 179.71 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.98 -55.19 31.9 Favored 'General case' 0 CA--C 1.52 -0.205 0 C-N-CA 120.511 -0.476 . . . . 0.0 110.276 -179.724 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.487 ' O ' ' O ' ' A' ' 31' ' ' ALA . 50.3 tp -43.94 -32.34 1.1 Allowed 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 110.12 -0.326 . . . . 0.0 110.12 -178.524 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.49 ' HB3' ' O ' ' A' ' 28' ' ' GLN . . . -58.24 -136.2 0.0 OUTLIER 'General case' 0 C--O 1.218 -0.6 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.84 178.99 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.453 ' O ' ' O ' ' A' ' 31' ' ' ALA . 9.4 m 55.12 113.15 0.02 OUTLIER Pre-proline 0 CA--C 1.538 0.488 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.836 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_exo -47.84 -45.77 23.45 Favored 'Trans proline' 0 C--N 1.309 -1.505 0 C-N-CA 122.395 2.064 . . . . 0.0 113.247 -179.211 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 51.7 m -54.14 -42.89 70.04 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.132 0.492 . . . . 0.0 111.188 -179.338 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.5 mmp_? -68.39 -34.42 76.01 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.066 179.832 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.49 ' O ' HG23 ' A' ' 40' ' ' THR . 3.6 mm? -64.55 -56.23 15.39 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.431 -0.508 . . . . 0.0 111.84 -179.025 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.493 ' O ' ' OG1' ' A' ' 40' ' ' THR . 3.3 ptm -58.26 -44.06 88.19 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.092 0.473 . . . . 0.0 110.037 179.752 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 92.4 mt -64.02 -43.9 97.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 121.492 0.663 . . . . 0.0 110.144 179.11 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.483 HD11 HD21 ' A' ' 89' ' ' LEU . 64.0 tp -59.51 -41.17 89.31 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.927 -179.575 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.493 ' OG1' ' O ' ' A' ' 37' ' ' MET . 41.4 p -63.93 -35.78 81.78 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.309 -179.754 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 89.8 mm-40 -63.61 -50.81 67.93 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 120.501 -0.48 . . . . 0.0 110.245 179.585 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 78.9 mt -63.44 -32.86 74.42 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.666 179.721 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 61.5 ttp180 -53.16 -39.49 63.61 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.197 -179.44 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 43.0 t-20 -61.92 -41.1 97.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.815 0.34 . . . . 0.0 110.593 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 168.5 177.62 39.64 Favored Glycine 0 CA--C 1.527 0.785 0 N-CA-C 111.016 -0.833 . . . . 0.0 111.016 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_endo -69.43 152.38 71.03 Favored 'Trans proline' 0 C--N 1.309 -1.503 0 C-N-CA 122.893 2.395 . . . . 0.0 111.897 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 1.3 pp 178.59 148.28 0.39 Allowed Pre-proline 0 N--CA 1.451 -0.418 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.789 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -72.63 -175.66 1.94 Allowed 'Trans proline' 0 N--CA 1.494 1.547 0 C-N-CA 122.756 2.304 . . . . 0.0 112.208 178.904 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.765 HG23 ' H ' ' A' ' 50' ' ' THR . 33.1 m -75.79 -61.42 1.7 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.582 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.912 179.471 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.765 ' H ' HG23 ' A' ' 49' ' ' VAL . 71.8 p -29.32 -46.1 0.05 Allowed 'General case' 0 N--CA 1.475 0.801 0 CA-C-O 121.464 0.649 . . . . 0.0 110.362 -179.449 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -62.33 -43.55 98.55 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.099 178.994 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.695 ' N ' ' O ' ' A' ' 49' ' ' VAL . 0.2 OUTLIER -61.33 -38.62 87.57 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.846 -179.754 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.533 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -61.53 -43.85 98.12 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.635 -0.505 . . . . 0.0 109.635 179.712 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -57.0 -46.48 82.24 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 179.628 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.28 -49.46 77.74 Favored 'General case' 0 C--O 1.231 0.094 0 C-N-CA 120.73 -0.388 . . . . 0.0 110.248 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 96.3 mt -92.7 -79.22 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.346 179.502 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' GLY . . . . . 0.533 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 141.76 89.73 0.14 Allowed Glycine 0 CA--C 1.519 0.331 0 N-CA-C 111.171 -0.772 . . . . 0.0 111.171 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 32.0 ttp 69.23 105.94 0.06 Allowed 'General case' 0 CA--C 1.52 -0.21 0 CA-C-O 120.53 0.205 . . . . 0.0 110.682 179.261 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 176.05 10.98 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.528 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -53.8 -37.56 63.64 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.705 -179.293 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 4.8 t -61.45 -48.94 78.83 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.951 -179.548 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.4 -35.68 68.05 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.224 -179.748 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 90.2 t -69.42 -52.96 27.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 C-N-CA 120.524 -0.47 . . . . 0.0 110.778 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 78.3 p -56.32 -43.32 78.88 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.876 0.369 . . . . 0.0 110.53 -179.79 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 55.9 t-80 -63.76 -51.07 66.51 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.019 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -61.04 -38.4 86.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.417 179.708 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.409 HD21 ' CD1' ' A' ' 87' ' ' TYR . 54.4 tp -60.84 -45.35 94.83 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.428 -179.81 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 74.1 ttt180 -60.77 -45.37 94.62 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-O 121.091 0.472 . . . . 0.0 110.509 -179.521 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 91.4 t -65.54 -54.5 27.53 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.386 0 C-N-CA 120.203 -0.599 . . . . 0.0 110.583 -179.759 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 97.7 mt -56.37 -40.73 75.04 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 -179.435 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 59.1 ttt85 -57.83 -39.64 78.15 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.26 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 97.6 m-20 -62.24 -43.54 98.59 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 120.548 -0.461 . . . . 0.0 110.594 -179.464 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.474 HD23 ' N ' ' A' ' 73' ' ' LEU . 7.0 mt -65.9 -44.72 84.4 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-O 120.953 0.406 . . . . 0.0 110.587 -179.29 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 104.15 96.56 2.41 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 111.612 -0.595 . . . . 0.0 111.612 179.606 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -171.92 -6.11 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.898 0.38 . . . . 0.0 110.654 179.205 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 30.8 m -138.83 157.62 29.52 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.19 179.656 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.423 HG12 ' N ' ' A' ' 78' ' ' GLY . 61.2 t -143.82 155.59 15.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.432 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' GLY . . . . . 0.423 ' N ' HG12 ' A' ' 77' ' ' VAL . . . -126.41 144.89 15.4 Favored Glycine 0 N--CA 1.462 0.429 0 N-CA-C 110.446 -1.062 . . . . 0.0 110.446 179.378 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 . . . . . 0 N--CA 1.466 0.328 0 N-CA-C 110.349 -0.241 . . . . 0.0 110.349 -179.996 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 20.1 m . . . . . 0 N--CA 1.463 0.209 0 N-CA-C 110.355 -0.239 . . . . 0.0 110.355 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.409 ' CD1' HD21 ' A' ' 67' ' ' LEU . 27.7 m-85 -115.75 136.58 52.91 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.463 -179.66 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 20.1 m -151.07 171.95 16.51 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.193 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.614 ' N ' HD12 ' A' ' 89' ' ' LEU . 8.3 mp -74.8 146.64 41.89 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.494 -179.91 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 58.6 t80 -52.18 -47.52 65.5 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.493 179.8 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.552 ' CG ' ' H ' ' A' ' 92' ' ' THR . 43.4 t0 -155.4 -177.42 6.54 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.387 -179.799 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' THR . . . . . 0.552 ' H ' ' CG ' ' A' ' 91' ' ' ASP . 5.5 t -77.48 6.84 6.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.451 -179.808 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 93' ' ' HIS . . . . . 0.417 ' CE1' ' OD2' ' A' ' 91' ' ' ASP . 34.9 m80 -62.27 -73.39 0.11 Allowed 'General case' 0 C--O 1.236 0.345 0 CA-C-O 120.976 0.417 . . . . 0.0 110.308 179.889 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 82.4 t -45.22 -40.19 2.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.29 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.46 -39.61 93.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.524 179.762 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 8.8 tp-100 -60.54 -47.43 86.2 Favored 'General case' 0 C--O 1.241 0.632 0 CA-C-O 121.095 0.474 . . . . 0.0 110.176 -179.412 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.649 HD21 ' HA ' ' B' ' 220' ' ' ALA . 7.2 mp -62.86 -43.28 99.22 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.263 -179.626 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 7.0 tp -63.58 -39.7 95.07 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.029 179.828 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 47.4 t0 -56.48 -47.63 78.82 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.169 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.531 ' N ' ' OE1' ' A' ' 100' ' ' GLU . 0.3 OUTLIER -63.33 -51.56 65.45 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 120.639 -0.425 . . . . 0.0 110.279 179.678 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 101' ' ' ALA . . . . . 0.665 ' HA ' HD21 ' B' ' 216' ' ' LEU . . . -56.48 -43.01 79.23 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.575 179.893 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 4.1 mm -61.45 -45.6 98.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 C-N-CA 120.512 -0.475 . . . . 0.0 110.502 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 85.1 t80 -61.85 -45.02 95.62 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.981 0.42 . . . . 0.0 110.449 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 11.6 t-160 -55.43 -45.24 76.78 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.601 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 35.3 t -76.07 -33.64 59.56 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.859 179.697 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 78.7 tt0 -58.88 -38.93 79.94 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.378 -179.471 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 7.6 t60 . . . . . 0 CA--C 1.521 -0.168 0 C-N-CA 120.503 -0.479 . . . . 0.0 110.159 -179.289 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 97.0 m-20 . . . . . 0 C--O 1.224 -0.28 0 CA-C-O 120.505 0.193 . . . . 0.0 110.746 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 27.3 t -39.32 -49.89 1.99 Allowed 'General case' 0 C--O 1.238 0.49 0 CA-C-O 121.439 0.637 . . . . 0.0 110.479 -179.655 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -64.23 -45.99 85.8 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.902 179.352 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 138' ' ' ALA . . . . . 0.608 ' O ' HG23 ' B' ' 142' ' ' VAL . . . -58.74 -28.27 65.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.419 -179.878 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 139' ' ' ALA . . . . . 0.461 ' HB1' ' HB3' ' A' ' 36' ' ' LEU . . . -71.39 -50.74 29.02 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-O 120.85 0.357 . . . . 0.0 110.168 179.865 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -62.78 -40.95 98.91 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.522 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -61.68 -51.19 69.46 Favored 'General case' 0 C--O 1.24 0.586 0 CA-C-O 121.395 0.617 . . . . 0.0 110.457 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 142' ' ' VAL . . . . . 0.608 HG23 ' O ' ' B' ' 138' ' ' ALA . 85.8 t -61.32 -44.33 98.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.013 179.844 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -56.38 -41.34 76.07 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 62.1 m -59.32 -45.36 91.53 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.178 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 46.9 p -64.0 -44.87 91.34 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.311 179.434 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 96.0 mt -66.4 -22.41 66.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.425 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 147' ' ' GLN . . . . . 0.525 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 59.5 tt0 -74.12 -59.08 2.89 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.29 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -60.78 -55.01 38.18 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 120.571 -0.452 . . . . 0.0 110.308 -179.632 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.475 ' O ' ' O ' ' B' ' 150' ' ' ALA . 47.8 tp -44.31 -31.3 0.99 Allowed 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 120.914 -0.314 . . . . 0.0 110.212 -178.684 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 150' ' ' ALA . . . . . 0.525 ' HB3' ' O ' ' B' ' 147' ' ' GLN . . . -59.16 -135.93 0.0 OUTLIER 'General case' 0 C--O 1.219 -0.524 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.614 179.07 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 151' ' ' THR . . . . . 0.454 ' O ' ' O ' ' B' ' 150' ' ' ALA . 10.1 m 53.97 113.31 0.01 OUTLIER Pre-proline 0 CA--C 1.538 0.505 0 CA-C-N 116.574 -0.284 . . . . 0.0 110.67 179.915 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -48.68 -46.89 22.63 Favored 'Trans proline' 0 C--N 1.309 -1.503 0 C-N-CA 122.169 1.913 . . . . 0.0 113.209 -178.865 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 66.8 m -52.91 -38.77 62.18 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.541 0.686 . . . . 0.0 111.052 -179.359 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 154' ' ' ARG . . . . . 0.4 HH11 ' HD3' ' B' ' 154' ' ' ARG . 3.5 mmp_? -71.75 -35.15 70.02 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.993 179.581 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 155' ' ' LEU . . . . . 0.464 ' HB3' ' HB1' ' A' ' 20' ' ' ALA . 3.8 mm? -64.16 -55.77 19.46 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.43 -0.508 . . . . 0.0 111.603 -179.046 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 156' ' ' MET . . . . . 0.432 ' O ' ' OG1' ' B' ' 159' ' ' THR . 0.1 OUTLIER -56.73 -46.26 81.42 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 179.677 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 97.4 mt -62.82 -43.04 98.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 C-N-CA 120.199 -0.6 . . . . 0.0 110.209 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 158' ' ' LEU . . . . . 0.477 HD11 HD21 ' B' ' 208' ' ' LEU . 58.4 tp -60.8 -42.59 97.93 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.287 -179.509 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 159' ' ' THR . . . . . 0.432 ' OG1' ' O ' ' B' ' 156' ' ' MET . 37.1 p -62.37 -35.37 78.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.112 -179.884 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 91.6 mm-40 -65.01 -50.75 65.04 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.965 0.412 . . . . 0.0 110.405 179.434 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 161' ' ' LEU . . . . . . . . . . . . . 82.2 mt -62.61 -32.64 73.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.72 179.766 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 162' ' ' ARG . . . . . . . . . . . . . 61.8 ttp180 -53.59 -39.04 64.52 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.33 -179.755 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 54.9 t-20 -61.19 -41.11 96.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.945 0.402 . . . . 0.0 110.405 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . 164.55 -176.7 40.38 Favored Glycine 0 CA--C 1.525 0.692 0 N-CA-C 111.12 -0.792 . . . . 0.0 111.12 179.433 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_exo -66.7 150.4 83.6 Favored 'Trans proline' 0 C--N 1.308 -1.6 0 C-N-CA 122.964 2.443 . . . . 0.0 111.937 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 1.7 pp -177.39 146.3 0.63 Allowed Pre-proline 0 N--CA 1.449 -0.509 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.573 178.924 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -74.53 174.99 11.66 Favored 'Trans proline' 0 N--CA 1.493 1.495 0 C-N-CA 122.873 2.382 . . . . 0.0 112.167 179.546 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . 3.6 m -71.42 -32.77 47.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 121.945 0.879 . . . . 0.0 110.808 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 169' ' ' THR . . . . . . . . . . . . . 50.4 p -58.16 -39.97 80.2 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-N 114.563 -1.199 . . . . 0.0 110.465 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 68.1 m-20 -68.53 -37.97 80.44 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.588 179.625 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 171' ' ' LEU . . . . . 0.627 ' O ' HD13 ' B' ' 171' ' ' LEU . 0.2 OUTLIER -63.76 -38.59 91.66 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.096 -179.365 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 172' ' ' ALA . . . . . 0.517 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -62.81 -46.64 87.01 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.661 179.85 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -56.12 -44.66 79.35 Favored 'General case' 0 C--O 1.232 0.151 0 C-N-CA 120.46 -0.496 . . . . 0.0 109.943 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -59.96 -50.32 74.21 Favored 'General case' 0 C--O 1.231 0.091 0 C-N-CA 120.664 -0.414 . . . . 0.0 110.438 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 97.1 mt -93.35 -78.24 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.187 179.542 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 176' ' ' GLY . . . . . 0.517 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 142.29 91.62 0.17 Allowed Glycine 0 CA--C 1.519 0.336 0 N-CA-C 111.441 -0.664 . . . . 0.0 111.441 179.779 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 32.7 ttp 66.83 107.6 0.04 OUTLIER 'General case' 0 CA--C 1.518 -0.268 0 CA-C-O 120.66 0.267 . . . . 0.0 110.905 179.169 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 178' ' ' GLU . . . . . 0.423 ' H ' ' H ' ' B' ' 179' ' ' GLN . 1.9 mt-10 174.63 12.43 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.618 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 179' ' ' GLN . . . . . 0.423 ' H ' ' H ' ' B' ' 178' ' ' GLU . 35.3 mt-30 -54.53 -38.14 66.22 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.61 -179.415 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 38.2 m -60.65 -48.29 82.43 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.855 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -57.08 -35.28 69.19 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.129 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 86.2 t -69.89 -53.37 24.31 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.774 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 77.6 p -57.14 -42.14 80.43 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.965 0.412 . . . . 0.0 110.572 -179.727 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 57.6 t-80 -63.92 -50.7 67.68 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-O 121.054 0.454 . . . . 0.0 110.794 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 85.6 mt-30 -62.3 -38.74 90.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.35 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 186' ' ' LEU . . . . . 0.451 HD21 ' CD1' ' B' ' 206' ' ' TYR . 58.1 tp -60.2 -45.14 94.18 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.219 -179.784 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 75.5 ttt180 -60.84 -44.45 96.95 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-O 121.135 0.493 . . . . 0.0 110.453 -179.572 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 88.9 t -66.74 -54.21 27.52 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.486 0 C-N-CA 120.121 -0.632 . . . . 0.0 110.709 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 97.7 mt -56.72 -41.32 77.25 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 -179.253 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 59.6 ttt85 -57.96 -39.97 79.42 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.237 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -61.19 -42.53 98.74 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 120.506 -0.478 . . . . 0.0 110.721 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 192' ' ' LEU . . . . . 0.495 HD23 ' N ' ' B' ' 192' ' ' LEU . 6.1 mt -66.96 -42.38 85.3 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.958 0.409 . . . . 0.0 110.5 -179.284 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 101.82 95.47 2.26 Favored Glycine 0 CA--C 1.524 0.647 0 N-CA-C 111.474 -0.65 . . . . 0.0 111.474 179.65 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 194' ' ' LEU . . . . . 0.413 ' H ' ' H ' ' B' ' 195' ' ' VAL . 0.5 OUTLIER -170.71 -7.93 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.924 0.393 . . . . 0.0 110.586 179.139 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 195' ' ' VAL . . . . . 0.413 ' H ' ' H ' ' B' ' 194' ' ' LEU . 22.4 m -136.79 156.11 34.45 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.08 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 196' ' ' VAL . . . . . 0.417 HG12 ' N ' ' B' ' 197' ' ' GLY . 66.5 t -143.53 155.34 16.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.39 -179.909 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 197' ' ' GLY . . . . . 0.417 ' N ' HG12 ' B' ' 196' ' ' VAL . . . -127.03 146.37 16.32 Favored Glycine 0 N--CA 1.463 0.484 0 N-CA-C 110.351 -1.099 . . . . 0.0 110.351 179.519 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 96.6 m-20 . . . . . 0 C--O 1.234 0.264 0 CA-C-O 120.606 0.241 . . . . 0.0 110.489 -179.85 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 23.5 m . . . . . 0 C--O 1.234 0.282 0 CA-C-O 120.69 0.281 . . . . 0.0 110.429 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 206' ' ' TYR . . . . . 0.451 ' CD1' HD21 ' B' ' 186' ' ' LEU . 40.5 m-85 -114.22 137.63 51.53 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.646 -179.51 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 14.9 m -151.75 172.0 16.82 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.343 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 208' ' ' LEU . . . . . 0.615 ' N ' HD12 ' B' ' 208' ' ' LEU . 8.4 mp -75.79 148.11 38.7 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.555 179.763 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 67.5 t80 -52.71 -46.71 67.45 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.358 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 210' ' ' ASP . . . . . 0.518 ' CG ' ' H ' ' B' ' 211' ' ' THR . 43.5 t0 -157.01 -177.4 6.59 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.807 0.337 . . . . 0.0 110.505 -179.827 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 211' ' ' THR . . . . . 0.518 ' H ' ' CG ' ' B' ' 210' ' ' ASP . 4.8 t -77.09 4.77 9.48 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.483 -179.861 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 212' ' ' HIS . . . . . 0.4 ' O ' ' N ' ' B' ' 215' ' ' GLN . 35.1 m80 -60.35 -74.72 0.07 Allowed 'General case' 0 C--O 1.237 0.395 0 CA-C-O 121.016 0.436 . . . . 0.0 110.327 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 71.3 t -44.5 -39.82 1.78 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.352 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 214' ' ' ALA . . . . . . . . . . . . . . . -63.26 -39.4 94.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.501 179.816 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 215' ' ' GLN . . . . . 0.4 ' N ' ' O ' ' B' ' 212' ' ' HIS . 8.8 tp-100 -59.87 -47.51 85.44 Favored 'General case' 0 C--O 1.24 0.559 0 CA-C-O 121.146 0.498 . . . . 0.0 110.013 -179.521 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 216' ' ' LEU . . . . . 0.665 HD21 ' HA ' ' A' ' 101' ' ' ALA . 7.3 mp -62.75 -42.62 99.76 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.146 -179.548 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 6.5 tp -63.73 -38.74 92.23 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.085 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 64.0 t0 -57.81 -46.19 85.03 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.928 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 219' ' ' GLU . . . . . 0.527 ' OE1' ' N ' ' B' ' 219' ' ' GLU . 0.3 OUTLIER -64.76 -50.72 65.73 Favored 'General case' 0 N--CA 1.462 0.163 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.37 179.631 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 220' ' ' ALA . . . . . 0.649 ' HA ' HD21 ' A' ' 97' ' ' LEU . . . -57.75 -42.79 84.66 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 120.876 0.369 . . . . 0.0 110.565 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 4.1 mm -62.07 -44.36 98.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.6 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 80.2 t80 -62.22 -44.55 96.32 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.965 0.412 . . . . 0.0 110.324 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 223' ' ' HIS . . . . . . . . . . . . . 11.6 t-160 -56.29 -44.9 80.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.675 -179.799 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 27.2 t -75.55 -36.34 60.47 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.939 179.669 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 80.3 tt0 -56.81 -37.93 71.88 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.308 -179.399 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 9.1 t60 . . . . . 0 C--N 1.332 -0.175 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.094 -179.467 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 . . . . . 0 N--CA 1.461 0.112 0 CA-C-O 120.927 0.394 . . . . 0.0 110.599 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 88.7 p -44.09 -50.05 8.63 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 121.334 0.588 . . . . 0.0 110.066 179.216 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -63.91 -44.46 92.87 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.191 179.758 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.486 ' O ' HG23 ' A' ' 23' ' ' VAL . . . -57.39 -29.51 64.14 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.407 179.785 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -72.96 -50.58 22.51 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 120.885 0.374 . . . . 0.0 110.205 179.645 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.75 -41.98 95.5 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.912 179.731 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 72.6 tp60 -64.64 -52.94 54.73 Favored 'General case' 0 C--O 1.242 0.664 0 CA-C-O 121.255 0.55 . . . . 0.0 110.622 -179.399 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.486 HG23 ' O ' ' A' ' 19' ' ' ALA . 93.0 t -63.17 -45.94 97.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.994 -179.808 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -53.43 -43.17 67.8 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.195 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 49.2 m -59.9 -44.15 94.43 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.799 0.333 . . . . 0.0 110.47 179.852 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 95.6 m -63.8 -51.0 66.75 Favored 'General case' 0 C--O 1.238 0.478 0 C-N-CA 120.619 -0.432 . . . . 0.0 110.835 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.431 ' N ' ' CD1' ' A' ' 27' ' ' LEU . 7.8 mp -66.94 -19.77 65.78 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.703 179.77 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.475 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 55.8 tt0 -74.82 -59.91 2.52 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.636 179.4 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -57.12 -52.15 66.46 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.445 -179.566 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 97.0 mt -54.81 -39.75 68.81 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.226 -179.173 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.561 ' O ' ' C ' ' A' ' 32' ' ' THR . . . -40.25 -73.33 0.05 OUTLIER 'General case' 0 CA--C 1.514 -0.442 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.299 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.561 ' C ' ' O ' ' A' ' 31' ' ' ALA . 94.9 m -2.98 107.08 0.03 OUTLIER Pre-proline 0 CA--C 1.539 0.533 0 O-C-N 124.556 1.16 . . . . 0.0 111.098 -179.339 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -44.19 -50.37 7.79 Favored 'Trans proline' 0 C--N 1.308 -1.577 0 C-N-CA 122.289 1.993 . . . . 0.0 113.039 -177.378 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 10.0 t -58.39 -46.78 85.7 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.034 -179.527 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.437 ' HA ' HE22 ' A' ' 66' ' ' GLN . 50.6 ttm-85 -64.09 -43.66 94.73 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.388 -179.505 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.563 HD23 ' O ' ' A' ' 36' ' ' LEU . 2.1 tt -61.09 -52.26 65.66 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.468 -0.493 . . . . 0.0 110.545 -178.915 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 49.0 ttp -53.87 -47.0 71.48 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.737 -0.385 . . . . 0.0 110.754 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.498 HG21 ' OE1' ' A' ' 66' ' ' GLN . 88.1 mt -60.81 -47.71 92.04 Favored 'Isoleucine or valine' 0 C--O 1.239 0.534 0 CA-C-O 121.36 0.6 . . . . 0.0 110.687 -179.254 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -62.56 -41.06 98.68 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.691 179.682 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 75.4 m -59.21 -40.53 86.09 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.861 179.799 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 53.6 tp60 -61.55 -44.99 96.04 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.311 -0.404 . . . . 0.0 109.989 -179.852 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.443 ' O ' ' N ' ' A' ' 44' ' ' ASN . 9.7 mt -66.83 -24.29 66.14 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.971 179.634 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.432 ' C ' ' O ' ' A' ' 42' ' ' LEU . 72.1 ttp85 -33.78 -35.71 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 O-C-N 123.578 0.549 . . . . 0.0 111.063 -179.347 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.708 ' HB3' HD11 ' A' ' 47' ' ' LEU . 58.0 t-20 -62.2 -72.92 0.11 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.212 179.26 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.503 ' H ' ' CD1' ' A' ' 47' ' ' LEU . . . 153.74 -75.07 0.24 Allowed Glycine 0 CA--C 1.526 0.778 0 N-CA-C 111.206 -0.758 . . . . 0.0 111.206 179.515 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.773 ' C ' HD12 ' A' ' 47' ' ' LEU . 71.6 Cg_endo -81.19 98.53 1.03 Allowed 'Trans proline' 0 C--N 1.312 -1.377 0 C-N-CA 122.655 2.237 . . . . 0.0 112.349 179.108 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.773 HD12 ' C ' ' A' ' 46' ' ' PRO . 5.1 mp -145.61 69.4 13.62 Favored Pre-proline 0 N--CA 1.465 0.28 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.236 179.475 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_exo -45.81 163.89 0.08 OUTLIER 'Trans proline' 0 C--N 1.308 -1.575 0 C-N-CA 122.563 2.175 . . . . 0.0 112.038 179.681 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 91.5 t -54.4 -47.07 70.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 121.129 0.49 . . . . 0.0 110.373 -178.927 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 66.4 p -63.98 -34.81 78.83 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.454 179.301 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -67.62 -39.94 84.68 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.807 179.879 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 16.5 mt -62.89 -40.01 96.22 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.925 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.569 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -59.67 -48.1 83.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.982 -0.554 . . . . 0.0 109.533 179.384 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 42.6 tp10 -56.91 -46.04 82.23 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.549 -0.46 . . . . 0.0 109.991 179.915 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -63.38 -51.21 66.8 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 120.73 -0.388 . . . . 0.0 110.662 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 97.5 mt -81.28 -71.0 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.519 -180.0 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' GLY . . . . . 0.569 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 130.53 75.01 0.14 Allowed Glycine 0 N--CA 1.463 0.449 0 N-CA-C 111.206 -0.757 . . . . 0.0 111.206 179.546 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 8.8 ttp 73.87 103.07 0.07 Allowed 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 120.993 -0.283 . . . . 0.0 110.848 179.343 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 179.89 17.68 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.383 179.608 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.411 ' HG3' ' H ' ' A' ' 60' ' ' GLN . 39.4 mt-30 -51.75 -32.09 29.21 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.8 -179.349 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 50.9 m -66.8 -43.56 83.59 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.91 179.845 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.87 -30.66 71.73 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.252 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 75.1 t -72.78 -52.84 20.94 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.235 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.579 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 69.4 m -56.35 -45.33 80.48 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.416 -179.292 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 62.9 m-70 -62.87 -49.73 73.68 Favored 'General case' 0 C--O 1.239 0.501 0 CA-C-O 121.214 0.531 . . . . 0.0 111.004 179.786 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' GLN . . . . . 0.498 ' OE1' HG21 ' A' ' 38' ' ' ILE . 51.2 tt0 -62.49 -38.73 91.01 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.233 -179.742 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.5 tt -61.57 -43.34 99.04 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.646 -179.937 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -61.69 -42.02 98.37 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.934 -0.306 . . . . 0.0 110.616 179.77 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 89.2 t -64.48 -55.04 23.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 C-N-CA 120.135 -0.626 . . . . 0.0 110.678 -179.614 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 10.8 mp -61.73 -41.04 97.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.961 0.41 . . . . 0.0 110.132 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 79.0 ttt-85 -56.19 -41.72 76.01 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.094 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 8.2 t-20 -58.25 -49.89 75.51 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.6 -0.44 . . . . 0.0 110.228 -179.563 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.546 HD22 ' N ' ' A' ' 73' ' ' LEU . 4.0 mm? -68.09 -41.64 81.55 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.816 179.29 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 105.12 43.24 1.66 Allowed Glycine 0 CA--C 1.524 0.648 0 N-CA-C 111.076 -0.81 . . . . 0.0 111.076 -179.776 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.489 ' N ' HD12 ' A' ' 75' ' ' LEU . 9.0 mp -97.4 -15.22 20.77 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 110.448 -0.204 . . . . 0.0 110.448 179.378 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 30.5 m -136.83 160.22 36.95 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.344 0 CA-C-O 120.801 0.334 . . . . 0.0 110.334 -179.85 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.422 HG12 ' N ' ' A' ' 78' ' ' GLY . 51.5 t -140.16 155.48 23.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.356 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' GLY . . . . . 0.422 ' N ' HG12 ' A' ' 77' ' ' VAL . . . -126.66 149.67 17.64 Favored Glycine 0 CA--C 1.521 0.431 0 N-CA-C 110.515 -1.034 . . . . 0.0 110.515 179.612 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 16.8 t70 . . . . . 0 C--O 1.236 0.388 0 N-CA-C 110.256 -0.276 . . . . 0.0 110.256 179.952 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 77.3 t . . . . . 0 N--CA 1.469 0.505 0 CA-C-O 120.629 0.252 . . . . 0.0 110.653 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -99.51 130.02 45.72 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.198 179.875 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 31.3 p -146.01 165.77 28.03 Favored 'General case' 0 C--O 1.224 -0.263 0 N-CA-C 109.816 -0.439 . . . . 0.0 109.816 -179.379 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.624 ' N ' HD12 ' A' ' 89' ' ' LEU . 8.0 mp -67.53 147.5 52.72 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.369 -179.416 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 61.3 t80 -50.55 -42.38 55.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.426 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 46.8 p30 -146.71 179.68 7.4 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.508 -0.315 . . . . 0.0 110.4 -179.937 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' THR . . . . . 0.595 ' O ' ' HB3' ' A' ' 95' ' ' ALA . 28.1 m -95.27 -17.65 21.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.499 -179.898 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 92.2 m-70 -40.97 -66.1 0.36 Allowed 'General case' 0 C--O 1.235 0.322 0 CA-C-O 121.368 0.604 . . . . 0.0 110.964 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 8.3 p -47.5 -34.89 3.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.347 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.595 ' HB3' ' O ' ' A' ' 92' ' ' THR . . . -64.08 -39.75 94.73 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.303 179.569 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -59.47 -45.43 91.66 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.919 -179.773 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.697 HD21 ' HA ' ' B' ' 220' ' ' ALA . 8.3 mp -60.74 -44.15 97.03 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.336 -0.546 . . . . 0.0 109.875 -179.315 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.558 HD11 HD21 ' A' ' 36' ' ' LEU . 6.1 tp -64.8 -38.33 90.62 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.526 179.521 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 63.9 t0 -57.05 -46.57 82.32 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.984 -179.487 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -70.32 -47.86 59.2 Favored 'General case' 0 C--O 1.232 0.152 0 C-N-CA 120.566 -0.454 . . . . 0.0 110.105 179.82 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' ALA . . . . . 0.679 ' HA ' HD21 ' B' ' 216' ' ' LEU . . . -53.46 -47.87 69.35 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.461 179.602 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 4.3 mm -63.09 -44.59 99.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 C-N-CA 120.626 -0.43 . . . . 0.0 110.64 -179.511 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 86.5 t80 -60.37 -41.42 93.68 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.018 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 64.7 t60 -69.28 -39.85 78.1 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.716 179.61 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 48.3 t -57.86 -47.82 81.59 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.544 -178.965 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -76.89 -54.45 6.58 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.94 0.4 . . . . 0.0 111.411 179.212 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 83.6 t60 . . . . . 0 CA--C 1.517 -0.318 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.268 -178.762 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 . . . . . 0 N--CA 1.463 0.19 0 CA-C-O 121.013 0.435 . . . . 0.0 110.591 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 83.4 p -44.51 -50.89 9.28 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.231 179.303 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -63.48 -44.01 95.65 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.235 179.861 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 138' ' ' ALA . . . . . 0.428 ' O ' HG23 ' B' ' 142' ' ' VAL . . . -57.73 -29.35 64.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.383 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -72.62 -50.33 26.02 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 121.106 0.479 . . . . 0.0 110.222 179.497 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -65.01 -40.94 95.64 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.724 179.67 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 66.1 tp60 -65.19 -53.59 42.35 Favored 'General case' 0 C--O 1.241 0.62 0 CA-C-O 121.272 0.558 . . . . 0.0 110.761 -179.298 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 142' ' ' VAL . . . . . 0.428 HG23 ' O ' ' B' ' 138' ' ' ALA . 92.6 t -62.97 -46.47 96.24 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.881 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -52.25 -43.67 64.48 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.229 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 51.0 m -59.88 -44.2 94.32 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.4 179.797 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 22.8 m -63.08 -51.76 65.37 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 120.493 -0.483 . . . . 0.0 111.065 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 146' ' ' LEU . . . . . 0.453 ' N ' ' CD1' ' B' ' 146' ' ' LEU . 7.7 mp -66.82 -19.79 65.81 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.667 179.761 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 147' ' ' GLN . . . . . 0.445 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 57.8 tt0 -74.38 -61.01 2.01 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.62 179.548 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -56.58 -51.63 67.9 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.631 -179.524 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.403 ' O ' ' C ' ' B' ' 150' ' ' ALA . 97.1 mt -55.2 -39.97 70.24 Favored 'General case' 0 CA--C 1.515 -0.386 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.307 -179.105 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 150' ' ' ALA . . . . . 0.558 ' O ' ' C ' ' B' ' 151' ' ' THR . . . -40.18 -73.94 0.04 OUTLIER 'General case' 0 CA--C 1.513 -0.464 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.262 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 151' ' ' THR . . . . . 0.558 ' C ' ' O ' ' B' ' 150' ' ' ALA . 92.4 m -2.24 106.87 0.03 OUTLIER Pre-proline 0 CA--C 1.539 0.528 0 O-C-N 124.627 1.204 . . . . 0.0 110.994 -179.333 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -43.72 -50.54 7.04 Favored 'Trans proline' 0 C--N 1.307 -1.638 0 C-N-CA 122.231 1.954 . . . . 0.0 112.977 -177.169 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 11.1 t -58.56 -46.32 87.13 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.985 -179.344 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 50.6 ttm-85 -63.68 -44.65 93.1 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 120.708 -0.397 . . . . 0.0 110.526 -179.497 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 155' ' ' LEU . . . . . 0.611 HD21 HD11 ' B' ' 217' ' ' LEU . 1.6 tt -60.88 -51.41 69.42 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.543 -0.463 . . . . 0.0 110.464 -178.972 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 50.4 ttp -54.07 -47.53 71.59 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.583 -0.447 . . . . 0.0 110.942 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 157' ' ' ILE . . . . . 0.491 HG21 ' OE1' ' B' ' 185' ' ' GLN . 90.5 mt -61.1 -47.51 93.24 Favored 'Isoleucine or valine' 0 C--O 1.239 0.526 0 CA-C-O 121.228 0.537 . . . . 0.0 110.58 -179.326 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -62.51 -41.16 98.66 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.654 179.467 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 159' ' ' THR . . . . . 0.435 ' OG1' ' CD2' ' B' ' 155' ' ' LEU . 18.6 m -59.37 -40.11 85.43 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.813 179.718 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 56.4 tp60 -61.6 -45.23 94.98 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.061 0.458 . . . . 0.0 109.921 -179.71 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 161' ' ' LEU . . . . . 0.438 ' O ' ' N ' ' B' ' 163' ' ' ASN . 9.5 mt -66.39 -23.84 66.39 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.96 179.702 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 162' ' ' ARG . . . . . 0.436 ' C ' ' O ' ' B' ' 161' ' ' LEU . 72.1 ttp85 -34.05 -35.54 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 O-C-N 123.533 0.521 . . . . 0.0 111.114 -179.214 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 163' ' ' ASN . . . . . 0.676 ' HB3' HD11 ' B' ' 166' ' ' LEU . 58.8 t-20 -61.77 -71.41 0.15 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.26 179.382 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 164' ' ' GLY . . . . . 0.479 ' H ' ' CD1' ' B' ' 166' ' ' LEU . . . 153.36 -76.33 0.22 Allowed Glycine 0 CA--C 1.527 0.822 0 N-CA-C 111.157 -0.777 . . . . 0.0 111.157 179.545 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 165' ' ' PRO . . . . . 0.792 ' C ' HD12 ' B' ' 166' ' ' LEU . 74.3 Cg_endo -82.08 101.74 1.16 Allowed 'Trans proline' 0 N--CA 1.492 1.391 0 C-N-CA 122.605 2.203 . . . . 0.0 112.182 179.174 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 166' ' ' LEU . . . . . 0.792 HD12 ' C ' ' B' ' 165' ' ' PRO . 5.3 mp -146.61 69.76 12.44 Favored Pre-proline 0 N--CA 1.464 0.246 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.397 179.666 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_exo -45.57 163.09 0.09 OUTLIER 'Trans proline' 0 C--N 1.307 -1.614 0 C-N-CA 122.52 2.147 . . . . 0.0 112.049 179.431 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . 87.6 t -53.85 -46.79 64.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 121.099 0.476 . . . . 0.0 110.402 -179.195 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 169' ' ' THR . . . . . . . . . . . . . 64.2 p -63.94 -35.46 80.74 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.472 179.374 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -66.79 -40.14 88.02 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.095 179.621 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 16.5 mt -63.12 -40.55 97.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.137 179.884 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 172' ' ' ALA . . . . . 0.577 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -59.06 -47.86 83.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.487 179.48 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 42.3 tp10 -57.02 -45.93 82.74 Favored 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 120.46 -0.496 . . . . 0.0 110.029 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -63.31 -49.72 72.89 Favored 'General case' 0 C--O 1.231 0.103 0 C-N-CA 120.669 -0.412 . . . . 0.0 110.717 -179.851 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 96.3 mt -82.62 -71.16 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.432 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 176' ' ' GLY . . . . . 0.577 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 129.8 74.25 0.14 Allowed Glycine 0 N--CA 1.463 0.476 0 N-CA-C 111.205 -0.758 . . . . 0.0 111.205 179.419 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 177' ' ' MET . . . . . 0.421 ' CB ' ' O ' ' B' ' 176' ' ' GLY . 3.4 tmm? 75.43 102.08 0.07 Allowed 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 120.668 -0.413 . . . . 0.0 110.879 179.407 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 179.26 18.08 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.335 179.679 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -52.5 -32.01 38.1 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.651 -179.299 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 47.0 m -66.4 -43.44 85.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.921 0.391 . . . . 0.0 110.903 179.72 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -63.92 -30.77 71.83 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.365 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 94.5 t -72.78 -52.86 20.83 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.244 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.777 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 74.3 m -56.49 -45.49 80.95 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.456 -179.48 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 58.6 m-70 -62.22 -48.91 77.89 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.111 0.481 . . . . 0.0 110.661 179.789 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 185' ' ' GLN . . . . . 0.491 ' OE1' HG21 ' B' ' 157' ' ' ILE . 50.6 tt0 -62.9 -39.72 95.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.262 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 5.4 tt -61.05 -43.31 99.07 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.559 -179.722 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -61.81 -42.36 98.92 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 120.979 -0.288 . . . . 0.0 110.687 179.712 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 99.4 t -64.18 -54.89 25.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 C-N-CA 120.158 -0.617 . . . . 0.0 110.691 -179.663 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 10.6 mp -61.75 -41.08 97.2 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.81 0.338 . . . . 0.0 110.164 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 79.5 ttt-85 -54.91 -42.52 72.3 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.156 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -57.82 -50.48 73.13 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.504 -0.478 . . . . 0.0 110.335 -179.683 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 192' ' ' LEU . . . . . 0.534 ' N ' HD22 ' B' ' 192' ' ' LEU . 3.9 mm? -66.76 -42.91 85.4 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.851 0.358 . . . . 0.0 110.853 179.496 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 105.77 42.14 1.74 Allowed Glycine 0 CA--C 1.525 0.717 0 N-CA-C 111.154 -0.778 . . . . 0.0 111.154 -179.881 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 194' ' ' LEU . . . . . 0.487 ' N ' HD12 ' B' ' 194' ' ' LEU . 8.1 mp -96.46 -15.1 21.92 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 120.496 0.189 . . . . 0.0 110.682 179.643 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 29.4 m -138.27 161.92 30.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.773 0.321 . . . . 0.0 110.269 -179.771 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 196' ' ' VAL . . . . . 0.461 HG12 ' N ' ' B' ' 197' ' ' GLY . 61.9 t -141.87 157.99 20.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.535 179.42 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 197' ' ' GLY . . . . . 0.461 ' N ' HG12 ' B' ' 196' ' ' VAL . . . -129.53 149.38 18.66 Favored Glycine 0 CA--C 1.521 0.447 0 N-CA-C 110.625 -0.99 . . . . 0.0 110.625 179.437 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 17.8 t70 . . . . . 0 C--O 1.237 0.428 0 CA-C-O 120.863 0.363 . . . . 0.0 110.709 -179.711 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 70.7 t . . . . . 0 N--CA 1.463 0.178 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 77.0 m-85 -102.59 132.7 48.51 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.468 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 36.1 p -150.07 169.26 21.65 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.029 -179.413 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 208' ' ' LEU . . . . . 0.619 ' N ' HD12 ' B' ' 208' ' ' LEU . 7.8 mp -68.78 149.18 49.29 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.566 -179.28 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 59.3 t80 -53.46 -43.81 68.42 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.547 179.709 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 40.7 p30 -144.47 179.9 6.97 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.42 -179.801 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 211' ' ' THR . . . . . 0.59 ' O ' ' HB3' ' B' ' 214' ' ' ALA . 25.4 m -96.16 -17.8 20.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.596 -179.92 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 212' ' ' HIS . . . . . . . . . . . . . 89.4 m-70 -40.77 -65.82 0.38 Allowed 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 121.38 0.61 . . . . 0.0 110.706 179.674 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 7.5 p -47.57 -34.45 3.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.345 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 214' ' ' ALA . . . . . 0.59 ' HB3' ' O ' ' B' ' 211' ' ' THR . . . -65.45 -38.25 89.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.08 179.491 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -60.89 -45.57 94.1 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.032 -179.772 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 216' ' ' LEU . . . . . 0.679 HD21 ' HA ' ' A' ' 101' ' ' ALA . 8.2 mp -61.09 -43.72 98.45 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.445 -0.502 . . . . 0.0 109.712 -179.579 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 217' ' ' LEU . . . . . 0.611 HD11 HD21 ' B' ' 155' ' ' LEU . 7.1 tp -64.47 -40.21 95.27 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.461 179.309 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 65.7 t0 -56.44 -46.31 80.35 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.028 -179.49 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 219' ' ' GLU . . . . . . . . . . . . . 16.7 tp10 -70.13 -48.94 55.36 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.146 179.724 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 220' ' ' ALA . . . . . 0.697 ' HA ' HD21 ' A' ' 97' ' ' LEU . . . -53.22 -47.53 68.89 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.331 179.584 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 4.5 mm -62.99 -44.6 99.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.597 -179.71 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 90.0 t80 -60.02 -42.82 95.18 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.985 -179.794 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 223' ' ' HIS . . . . . . . . . . . . . 47.8 t60 -68.41 -38.69 81.48 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.619 179.247 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 11.5 t -57.41 -48.78 78.19 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.648 -178.827 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -77.14 -53.19 8.07 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.958 0.408 . . . . 0.0 111.428 179.111 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 86.2 t60 . . . . . 0 CA--C 1.518 -0.261 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.274 -178.794 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 . . . . . 0 N--CA 1.464 0.27 0 CA-C-O 120.781 0.324 . . . . 0.0 110.645 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 11.4 t -56.43 -48.16 77.55 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-O 121.362 0.601 . . . . 0.0 109.723 179.338 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 90.7 mm-40 -65.3 -47.48 76.45 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.02 179.42 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.712 ' O ' HG23 ' A' ' 23' ' ' VAL . . . -56.31 -29.12 60.82 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.237 -179.896 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -71.28 -49.71 40.2 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 120.867 -0.333 . . . . 0.0 110.152 179.554 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.25 -44.01 95.62 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.525 179.908 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -59.4 -49.36 78.09 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-O 121.162 0.506 . . . . 0.0 110.352 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.712 HG23 ' O ' ' A' ' 19' ' ' ALA . 84.4 t -61.71 -44.26 98.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.025 179.626 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.505 ' HB1' ' N ' ' B' ' 151' ' ' THR . . . -57.78 -41.9 82.99 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 120.876 0.37 . . . . 0.0 110.032 179.868 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 48.3 t -58.76 -44.84 90.69 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.021 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.453 ' OG1' ' O ' ' A' ' 23' ' ' VAL . 71.3 p -64.42 -47.28 79.73 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 120.989 0.423 . . . . 0.0 110.566 179.362 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 95.1 mt -63.95 -23.77 67.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.406 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.494 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 54.9 tt0 -75.65 -56.49 4.64 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.733 179.542 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.65 -55.1 39.38 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.786 -179.333 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.478 ' O ' ' O ' ' A' ' 31' ' ' ALA . 3.8 mm? -46.8 -35.14 5.92 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 -179.18 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.494 ' HB3' ' O ' ' A' ' 28' ' ' GLN . . . -55.07 -161.92 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.064 -0.517 . . . . 0.0 109.858 179.428 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.549 ' CB ' HH11 ' A' ' 35' ' ' ARG . 1.0 OUTLIER 81.86 114.41 0.03 OUTLIER Pre-proline 0 C--N 1.323 -0.544 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.182 179.827 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -49.19 -42.6 39.34 Favored 'Trans proline' 0 N--CA 1.496 1.641 0 C-N-CA 122.265 1.977 . . . . 0.0 112.957 -179.14 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 47.4 t -59.36 -45.54 91.11 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.881 -179.191 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.549 HH11 ' CB ' ' A' ' 32' ' ' THR . 84.6 mtt85 -62.03 -44.31 96.98 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.738 -0.385 . . . . 0.0 111.186 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -61.3 -47.59 85.27 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.476 -0.49 . . . . 0.0 110.96 -179.52 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.435 ' O ' ' OE1' ' A' ' 41' ' ' GLN . 20.2 ttm -56.54 -48.95 76.19 Favored 'General case' 0 C--N 1.319 -0.743 0 C-N-CA 120.285 -0.566 . . . . 0.0 110.301 -179.804 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 37.8 mm -63.5 -43.66 98.45 Favored 'Isoleucine or valine' 0 C--O 1.234 0.256 0 CA-C-O 121.045 0.45 . . . . 0.0 110.44 -179.752 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 mt -62.15 -39.75 93.66 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.456 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 18.0 m -60.55 -43.72 96.9 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.101 -0.5 . . . . 0.0 109.981 179.796 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.435 ' OE1' ' O ' ' A' ' 37' ' ' MET . 3.4 mp0 -61.31 -44.9 96.44 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.985 0.422 . . . . 0.0 110.041 179.809 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 97.9 mt -61.79 -40.23 94.47 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.066 -179.434 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.536 ' NH2' ' OD2' ' A' ' 99' ' ' ASP . 20.3 tpt180 -63.72 -37.67 88.21 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.951 179.974 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -56.95 -42.33 79.91 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.692 -178.54 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 169.38 -174.49 43.77 Favored Glycine 0 CA--C 1.527 0.786 0 N-CA-C 111.007 -0.837 . . . . 0.0 111.007 179.724 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -77.83 122.34 5.83 Favored 'Trans proline' 0 C--N 1.311 -1.408 0 C-N-CA 122.819 2.346 . . . . 0.0 111.663 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.441 ' H ' HD12 ' A' ' 47' ' ' LEU . 0.2 OUTLIER -150.16 95.89 3.55 Favored Pre-proline 0 CA--C 1.537 0.451 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.961 -179.248 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_exo -47.06 173.22 0.03 OUTLIER 'Trans proline' 0 C--N 1.306 -1.664 0 C-N-CA 122.495 2.13 . . . . 0.0 112.284 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 73.0 t -54.64 -45.02 72.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.433 -179.23 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 15.3 m -59.78 -40.24 87.62 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.22 0.533 . . . . 0.0 110.255 179.208 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 56.3 t0 -65.71 -38.98 90.68 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.16 179.517 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.6 ' O ' HD13 ' A' ' 52' ' ' LEU . 0.3 OUTLIER -62.46 -44.19 97.0 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-O 121.308 0.575 . . . . 0.0 110.028 -179.565 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.497 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -55.87 -48.44 75.57 Favored 'General case' 0 N--CA 1.444 -0.738 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 179.707 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 44.9 tp10 -56.48 -48.43 77.14 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.318 -0.553 . . . . 0.0 110.549 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -54.29 -58.07 8.8 Favored 'General case' 0 C--N 1.332 -0.163 0 C-N-CA 120.896 -0.322 . . . . 0.0 110.614 -179.467 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 90.6 mt -86.35 -73.16 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.417 179.775 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' GLY . . . . . 0.497 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 131.88 98.09 0.72 Allowed Glycine 0 N--CA 1.461 0.316 0 N-CA-C 111.055 -0.818 . . . . 0.0 111.055 -179.679 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 64.3 mtt 66.48 99.54 0.05 OUTLIER 'General case' 0 C--N 1.34 0.18 0 CA-C-O 120.767 0.317 . . . . 0.0 110.722 178.889 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.41 ' H ' ' H ' ' A' ' 60' ' ' GLN . 2.1 mt-10 -179.53 15.12 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.359 179.864 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.41 ' H ' ' H ' ' A' ' 59' ' ' GLU . 52.0 mt-30 -55.54 -36.9 67.29 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.549 -179.372 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 78.1 p -62.09 -49.29 76.53 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.821 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.34 -35.87 72.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.278 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 75.8 t -67.19 -52.95 37.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.596 -179.694 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 10.4 t -56.84 -42.29 79.38 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.248 -179.416 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -63.17 -49.8 72.88 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.816 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 86.6 mm-40 -63.72 -41.17 98.12 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.594 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.8 tp -62.52 -44.66 95.82 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.359 -179.679 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 70.4 mmt-85 -62.43 -42.42 99.44 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.848 0.356 . . . . 0.0 110.66 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 71.9 t -67.23 -54.37 24.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 C-N-CA 120.262 -0.575 . . . . 0.0 110.468 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 92.4 mt -58.49 -41.4 85.24 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.063 -179.323 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 73.5 ttt180 -58.55 -41.67 86.14 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.405 179.729 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 93.3 m-20 -57.65 -50.39 73.32 Favored 'General case' 0 C--N 1.332 -0.171 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.455 -179.421 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.8 mt -67.7 -40.76 84.3 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.934 0.397 . . . . 0.0 110.407 -179.887 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 103.09 78.76 1.31 Allowed Glycine 0 CA--C 1.52 0.398 0 N-CA-C 110.872 -0.891 . . . . 0.0 110.872 -179.644 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.424 HD11 HG21 ' A' ' 94' ' ' VAL . 6.7 tp -144.9 -9.35 0.61 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.943 0.401 . . . . 0.0 110.793 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 33.8 m -139.05 158.34 29.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.454 -179.859 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.476 HG12 ' N ' ' A' ' 78' ' ' GLY . 48.4 t -143.99 157.69 15.87 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.577 -179.793 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' GLY . . . . . 0.476 ' N ' HG12 ' A' ' 77' ' ' VAL . . . -134.44 144.48 16.45 Favored Glycine 0 CA--C 1.521 0.463 0 N-CA-C 110.388 -1.085 . . . . 0.0 110.388 179.623 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 46.9 t0 . . . . . 0 C--O 1.234 0.243 0 CA-C-O 120.919 0.39 . . . . 0.0 110.343 179.519 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 46.6 t . . . . . 0 C--O 1.224 -0.278 0 CA-C-O 120.752 0.31 . . . . 0.0 110.218 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -106.88 131.47 53.93 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.288 179.749 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.435 ' O ' ' O ' ' A' ' 77' ' ' VAL . 99.9 p -150.09 166.88 28.42 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.487 ' O ' ' N ' ' A' ' 91' ' ' ASP . 0.3 OUTLIER -78.9 154.16 29.93 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.175 -179.361 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.402 ' CE2' ' OG1' ' A' ' 92' ' ' THR . 71.0 t80 -46.17 -15.55 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.434 179.688 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.487 ' N ' ' O ' ' A' ' 89' ' ' LEU . 52.8 t0 41.94 89.81 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.189 179.055 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 92' ' ' THR . . . . . 0.459 ' OG1' ' O ' ' A' ' 91' ' ' ASP . 2.1 m -169.58 -133.8 0.02 OUTLIER 'General case' 0 C--O 1.236 0.353 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.56 179.656 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 93' ' ' HIS . . . . . 0.444 ' H ' HG22 ' A' ' 92' ' ' THR . 40.4 m80 -55.08 -53.06 60.65 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.021 -179.89 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.424 HG21 HD11 ' A' ' 75' ' ' LEU . 95.3 t -49.78 -39.53 14.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.245 179.754 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.52 -41.44 98.86 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.485 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 58.6 tt0 -60.65 -46.34 90.71 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.006 0.432 . . . . 0.0 110.11 -179.865 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.463 HD11 ' N ' ' B' ' 220' ' ' ALA . 3.7 mm? -62.32 -43.14 99.52 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.433 179.677 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.504 ' O ' HG22 ' A' ' 102' ' ' ILE . 62.3 tp -65.06 -39.29 93.07 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.422 179.869 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 99' ' ' ASP . . . . . 0.536 ' OD2' ' NH2' ' A' ' 43' ' ' ARG . 94.2 m-20 -62.71 -39.84 95.27 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.154 0.502 . . . . 0.0 110.839 -178.983 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.464 ' OE2' ' OE2' ' B' ' 219' ' ' GLU . 97.5 mt-10 -74.16 -52.62 11.93 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.825 179.67 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 101' ' ' ALA . . . . . 0.447 ' N ' HD11 ' B' ' 216' ' ' LEU . . . -57.89 -48.37 80.06 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.965 -179.629 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.561 HG23 ' N ' ' A' ' 103' ' ' TYR . 10.4 tp -64.73 -46.1 93.2 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 CA-C-O 120.892 0.377 . . . . 0.0 111.111 -179.096 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 103' ' ' TYR . . . . . 0.561 ' N ' HG23 ' A' ' 102' ' ' ILE . 91.0 t80 -62.98 -43.97 97.31 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.783 -179.422 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 3.4 m-70 -67.31 -41.44 85.32 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.756 -179.734 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 6.4 t -67.93 -44.29 77.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.977 0.417 . . . . 0.0 110.744 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 15.1 tm-20 -67.63 -29.2 68.46 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.569 -179.811 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 18.7 t60 . . . . . 0 N--CA 1.454 -0.26 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.262 -178.946 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 . . . . . 0 N--CA 1.464 0.255 0 CA-C-O 120.833 0.349 . . . . 0.0 110.639 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 9.9 t -55.15 -48.68 73.38 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.236 0.541 . . . . 0.0 109.788 179.514 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 95.6 mm-40 -65.36 -47.6 75.88 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.937 179.535 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 138' ' ' ALA . . . . . 0.609 ' O ' HG23 ' B' ' 142' ' ' VAL . . . -56.02 -29.81 60.93 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.196 -179.837 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -71.28 -49.88 38.34 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 120.888 0.375 . . . . 0.0 110.156 179.653 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -61.1 -41.14 96.12 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.529 179.953 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -61.21 -49.86 75.45 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-O 121.214 0.531 . . . . 0.0 110.427 179.71 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 142' ' ' VAL . . . . . 0.609 HG23 ' O ' ' B' ' 138' ' ' ALA . 93.5 t -61.78 -44.46 98.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.145 179.697 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 143' ' ' ALA . . . . . 0.477 ' HB1' ' N ' ' A' ' 32' ' ' THR . . . -57.01 -42.19 79.88 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 120.804 0.335 . . . . 0.0 110.167 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 14.0 t -58.71 -44.97 90.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.98 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 77.5 p -64.2 -46.36 84.27 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 120.967 0.413 . . . . 0.0 110.451 179.466 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 95.4 mt -64.51 -23.4 67.26 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.435 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 147' ' ' GLN . . . . . 0.484 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 57.1 tt0 -75.64 -56.36 4.76 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.785 179.527 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -59.12 -55.2 38.03 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.766 -179.393 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.467 ' O ' ' O ' ' B' ' 150' ' ' ALA . 3.8 mm? -46.66 -36.38 6.99 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 -179.127 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 150' ' ' ALA . . . . . 0.484 ' HB3' ' O ' ' B' ' 147' ' ' GLN . . . -54.86 -162.2 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.927 179.602 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 151' ' ' THR . . . . . 0.562 ' CB ' HH11 ' B' ' 154' ' ' ARG . 0.6 OUTLIER 82.79 115.07 0.03 OUTLIER Pre-proline 0 CA--C 1.54 0.564 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.294 179.694 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -48.98 -42.68 37.74 Favored 'Trans proline' 0 N--CA 1.496 1.618 0 C-N-CA 122.18 1.92 . . . . 0.0 113.063 -179.303 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 39.6 t -60.16 -45.97 91.28 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.976 -179.131 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 154' ' ' ARG . . . . . 0.562 HH11 ' CB ' ' B' ' 151' ' ' THR . 84.4 mtt85 -62.56 -43.6 98.41 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.125 -179.722 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 155' ' ' LEU . . . . . 0.415 HD13 ' HA ' ' B' ' 155' ' ' LEU . 4.2 mm? -62.69 -47.0 85.52 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.72 -0.392 . . . . 0.0 111.036 -179.479 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 36.4 ttp -58.34 -48.92 79.01 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.266 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 35.3 mm -63.28 -43.84 98.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 121.054 0.454 . . . . 0.0 110.371 179.76 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 36.9 mt -61.5 -40.68 95.48 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.222 -179.709 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 19.9 m -59.97 -45.14 93.66 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.005 179.694 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -58.03 -45.1 87.5 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.676 -0.41 . . . . 0.0 109.991 179.864 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 161' ' ' LEU . . . . . . . . . . . . . 97.0 mt -62.03 -40.07 94.47 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.122 0.486 . . . . 0.0 109.996 -179.47 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 162' ' ' ARG . . . . . 0.548 ' NH2' ' OD2' ' B' ' 218' ' ' ASP . 21.5 tpt180 -63.52 -37.99 89.41 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.951 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 98.4 m-20 -56.57 -42.09 78.04 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.588 -178.64 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . 169.43 -175.91 43.56 Favored Glycine 0 CA--C 1.528 0.876 0 N-CA-C 110.997 -0.841 . . . . 0.0 110.997 179.665 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -76.99 123.26 6.66 Favored 'Trans proline' 0 N--CA 1.492 1.413 0 C-N-CA 122.856 2.371 . . . . 0.0 111.593 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 166' ' ' LEU . . . . . 0.449 ' H ' HD12 ' B' ' 166' ' ' LEU . 0.2 OUTLIER -150.61 96.38 3.39 Favored Pre-proline 0 CA--C 1.538 0.504 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.016 -179.238 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_exo -47.06 173.31 0.03 OUTLIER 'Trans proline' 0 C--N 1.306 -1.71 0 C-N-CA 122.456 2.104 . . . . 0.0 112.309 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . 81.7 t -54.77 -45.2 73.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.43 -179.292 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 169' ' ' THR . . . . . . . . . . . . . 15.7 m -59.99 -40.28 88.61 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.186 0.517 . . . . 0.0 110.229 179.199 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -65.45 -38.64 90.45 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.191 179.297 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 171' ' ' LEU . . . . . 0.597 ' O ' HD13 ' B' ' 171' ' ' LEU . 0.3 OUTLIER -62.63 -44.82 95.33 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.272 0.558 . . . . 0.0 110.011 -179.587 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 172' ' ' ALA . . . . . 0.486 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -55.66 -48.07 75.64 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 179.782 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 43.6 tp10 -56.04 -48.39 76.07 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.308 -0.557 . . . . 0.0 110.502 179.767 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -54.82 -58.35 7.93 Favored 'General case' 0 C--N 1.333 -0.136 0 C-N-CA 120.749 -0.38 . . . . 0.0 110.776 -179.511 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 87.7 mt -86.62 -72.98 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.454 179.847 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 176' ' ' GLY . . . . . 0.486 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 130.54 99.41 0.84 Allowed Glycine 0 N--CA 1.461 0.323 0 N-CA-C 111.119 -0.792 . . . . 0.0 111.119 -179.779 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 62.5 mtt 66.27 95.71 0.06 Allowed 'General case' 0 CA--C 1.521 -0.172 0 CA-C-O 120.887 0.375 . . . . 0.0 110.745 178.79 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -176.71 14.65 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.404 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 54.8 mt-30 -55.79 -37.07 68.11 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.64 -179.247 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 64.3 p -61.49 -48.43 81.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.036 -179.726 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -59.2 -35.4 73.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.233 -179.902 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 97.5 t -67.12 -52.91 38.38 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.101 0 C-N-CA 120.467 -0.493 . . . . 0.0 110.726 -179.713 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 10.7 t -57.11 -42.18 80.33 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.289 -179.576 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 86.0 t60 -63.42 -50.27 70.48 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.905 -179.904 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 90.6 mm-40 -63.69 -40.48 96.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.949 0.404 . . . . 0.0 110.668 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 8.6 tp -62.52 -44.94 95.13 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.403 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 73.1 mmt-85 -62.46 -42.31 99.38 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.746 -179.761 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 77.7 t -66.34 -54.58 24.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 C-N-CA 120.179 -0.608 . . . . 0.0 110.506 -179.741 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 87.2 mt -58.83 -41.15 86.19 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 -179.251 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 71.8 ttt180 -57.95 -41.37 82.69 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.272 179.704 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 -59.82 -49.87 76.03 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 120.488 -0.485 . . . . 0.0 110.447 -179.33 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 192' ' ' LEU . . . . . 0.4 ' N ' HD23 ' B' ' 192' ' ' LEU . 9.2 mt -67.55 -39.41 84.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.816 0.341 . . . . 0.0 110.464 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 101.28 80.98 1.54 Allowed Glycine 0 N--CA 1.462 0.42 0 N-CA-C 110.727 -0.949 . . . . 0.0 110.727 -179.639 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 194' ' ' LEU . . . . . 0.419 HD21 HD11 ' B' ' 149' ' ' LEU . 4.9 tp -147.47 -9.68 0.42 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.777 0.322 . . . . 0.0 110.768 -179.932 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 26.7 m -140.05 159.18 26.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.412 -179.636 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 196' ' ' VAL . . . . . 0.515 HG12 ' N ' ' B' ' 197' ' ' GLY . 47.7 t -145.62 159.62 12.46 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.493 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 197' ' ' GLY . . . . . 0.515 ' N ' HG12 ' B' ' 196' ' ' VAL . . . -135.68 145.21 17.22 Favored Glycine 0 CA--C 1.523 0.563 0 N-CA-C 110.409 -1.077 . . . . 0.0 110.409 179.615 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 67.3 t0 . . . . . 0 C--O 1.234 0.27 0 CA-C-O 120.868 0.366 . . . . 0.0 110.337 179.564 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 47.2 t . . . . . 0 N--CA 1.465 0.304 0 CA-C-O 120.785 0.326 . . . . 0.0 110.179 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 96.3 m-85 -106.07 131.97 52.7 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.417 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 207' ' ' SER . . . . . 0.443 ' O ' ' O ' ' B' ' 196' ' ' VAL . 40.6 p -150.52 167.26 27.72 Favored 'General case' 0 CA--C 1.52 -0.196 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 208' ' ' LEU . . . . . 0.475 ' O ' HD12 ' B' ' 208' ' ' LEU . 0.3 OUTLIER -78.97 154.12 29.81 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.224 -179.158 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 66.4 t80 -46.36 -15.85 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.805 0.336 . . . . 0.0 110.529 179.647 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 210' ' ' ASP . . . . . 0.473 ' N ' ' O ' ' B' ' 208' ' ' LEU . 35.5 t0 42.45 89.72 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.21 179.107 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 211' ' ' THR . . . . . 0.489 HG22 ' H ' ' B' ' 212' ' ' HIS . 2.3 m -169.32 -134.77 0.02 OUTLIER 'General case' 0 C--O 1.238 0.47 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.471 179.634 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 212' ' ' HIS . . . . . 0.489 ' H ' HG22 ' B' ' 211' ' ' THR . 40.4 m80 -55.36 -53.51 55.3 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.02 -179.904 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 92.9 t -48.9 -38.88 11.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.214 179.741 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 214' ' ' ALA . . . . . . . . . . . . . . . -63.26 -42.24 99.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.347 179.831 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 58.8 tt0 -58.78 -46.62 87.1 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.073 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 216' ' ' LEU . . . . . 0.457 ' CD2' ' N ' ' B' ' 216' ' ' LEU . 3.5 mm? -61.99 -42.69 99.42 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.441 179.647 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 217' ' ' LEU . . . . . 0.476 ' O ' HG22 ' B' ' 221' ' ' ILE . 58.1 tp -65.4 -39.97 92.83 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.509 179.75 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 218' ' ' ASP . . . . . 0.548 ' OD2' ' NH2' ' B' ' 162' ' ' ARG . 98.8 m-20 -62.46 -40.16 95.74 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.163 0.506 . . . . 0.0 110.975 -178.941 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 219' ' ' GLU . . . . . 0.464 ' OE2' ' OE2' ' A' ' 100' ' ' GLU . 97.0 mt-10 -74.36 -53.45 9.62 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.807 179.564 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 220' ' ' ALA . . . . . 0.463 ' N ' HD11 ' A' ' 97' ' ' LEU . . . -56.8 -48.75 77.25 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.852 -179.305 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 221' ' ' ILE . . . . . 0.54 HG23 ' N ' ' B' ' 222' ' ' TYR . 3.8 tp -64.94 -45.76 93.77 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 C-N-CA 120.571 -0.452 . . . . 0.0 111.11 -179.174 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 222' ' ' TYR . . . . . 0.54 ' N ' HG23 ' B' ' 221' ' ' ILE . 90.4 t80 -62.36 -43.75 98.09 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.547 -179.46 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 223' ' ' HIS . . . . . . . . . . . . . 2.9 m-70 -67.47 -41.45 84.58 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.7 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 6.2 t -68.02 -44.5 76.37 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.915 0.388 . . . . 0.0 110.834 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 15.3 tm-20 -67.81 -28.78 67.87 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.664 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 15.7 t60 . . . . . 0 N--CA 1.454 -0.253 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.263 -178.987 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ASP . . . . . 0.448 ' OD1' ' N ' ' A' ' 16' ' ' ASP . 22.8 p-10 . . . . . 0 N--CA 1.464 0.254 0 CA-C-O 120.948 0.404 . . . . 0.0 110.673 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 78.3 p -54.74 -49.69 70.19 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.299 178.926 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 11.1 tp-100 -62.44 -45.1 94.59 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.308 -0.405 . . . . 0.0 109.909 179.808 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.557 ' O ' HG23 ' A' ' 23' ' ' VAL . . . -57.14 -29.41 63.56 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.377 179.914 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -72.72 -51.73 18.04 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 121.201 0.524 . . . . 0.0 110.416 179.547 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.2 -41.08 97.23 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.954 179.76 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 59.4 tt0 -64.92 -53.3 48.68 Favored 'General case' 0 C--O 1.241 0.654 0 CA-C-O 121.279 0.561 . . . . 0.0 110.902 -179.412 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.557 HG23 ' O ' ' A' ' 19' ' ' ALA . 96.6 t -61.56 -44.29 98.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.183 179.633 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -54.71 -42.53 71.61 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 179.714 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.6 t -58.81 -44.77 90.89 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 179.736 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 12.0 m -63.3 -45.73 90.0 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.26 179.024 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 95.7 mt -64.85 -22.28 66.96 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.523 179.717 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.524 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 58.1 tt0 -74.77 -55.66 5.6 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.425 179.49 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.66 -55.58 33.31 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.375 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.509 ' O ' ' O ' ' A' ' 31' ' ' ALA . 89.9 mt -44.94 -34.64 2.49 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.312 -179.565 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.524 ' HB3' ' O ' ' A' ' 28' ' ' GLN . . . -56.41 -139.97 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 O-C-N 123.517 0.511 . . . . 0.0 110.568 179.152 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.456 ' O ' ' O ' ' A' ' 31' ' ' ALA . 85.4 m 57.23 115.3 0.02 OUTLIER Pre-proline 0 C--N 1.323 -0.575 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.547 179.784 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -49.55 -46.76 25.41 Favored 'Trans proline' 0 N--CA 1.493 1.465 0 C-N-CA 122.371 2.047 . . . . 0.0 112.722 -179.337 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 57.9 m -62.87 -46.82 86.05 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.307 -178.876 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.2 tpp180 -63.01 -47.62 82.3 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.448 -178.824 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.584 HD23 ' O ' ' A' ' 36' ' ' LEU . 3.2 tt -60.38 -53.27 59.56 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.439 -178.636 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 62.1 ttp -50.77 -48.3 59.37 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-O 120.909 0.385 . . . . 0.0 110.167 179.776 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 5.5 mm -62.26 -43.83 98.44 Favored 'Isoleucine or valine' 0 C--O 1.239 0.519 0 CA-C-O 121.091 0.472 . . . . 0.0 110.525 179.501 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 14.3 mt -61.79 -41.11 97.32 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.288 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 9.8 m -58.36 -40.44 82.26 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.01 -0.541 . . . . 0.0 109.672 179.539 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 50.5 mt-30 -61.85 -44.28 97.15 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.469 179.499 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.517 ' O ' ' N ' ' A' ' 44' ' ' ASN . 80.5 mt -63.46 -31.57 72.76 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.127 179.472 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.548 HH21 ' CG ' ' A' ' 99' ' ' ASP . 33.4 tpt85 -33.9 -32.5 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 O-C-N 123.534 0.521 . . . . 0.0 110.866 -179.593 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.517 ' N ' ' O ' ' A' ' 42' ' ' LEU . 81.2 m-20 -72.44 -84.22 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.43 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 149.73 -76.37 0.24 Allowed Glycine 0 CA--C 1.527 0.82 0 N-CA-C 110.882 -0.887 . . . . 0.0 110.882 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -68.71 84.25 0.51 Allowed 'Trans proline' 0 C--N 1.307 -1.652 0 C-N-CA 122.742 2.294 . . . . 0.0 112.328 -179.379 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -156.9 68.07 4.33 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-O 121.045 0.45 . . . . 0.0 110.108 -179.747 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_exo -45.07 170.52 0.02 OUTLIER 'Trans proline' 0 C--N 1.298 -2.107 0 C-N-CA 122.416 2.078 . . . . 0.0 112.168 -179.837 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 80.8 t -54.32 -45.44 68.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.335 -179.593 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 15.1 m -61.34 -39.23 89.8 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.16 0.505 . . . . 0.0 110.292 179.117 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -66.31 -41.29 89.9 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.106 179.686 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.616 ' O ' HD13 ' A' ' 52' ' ' LEU . 0.2 OUTLIER -61.77 -42.58 99.17 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.775 -179.764 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.577 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -56.37 -47.78 78.19 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 179.323 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -54.64 -45.27 73.75 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.686 -0.406 . . . . 0.0 109.939 179.639 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -55.52 -57.59 11.27 Favored 'General case' 0 C--N 1.333 -0.139 0 C-N-CA 120.763 -0.375 . . . . 0.0 110.649 179.687 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 95.3 mt -80.48 -69.11 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.389 179.36 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' GLY . . . . . 0.577 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 131.95 75.93 0.12 Allowed Glycine 0 CA--C 1.521 0.438 0 N-CA-C 110.931 -0.868 . . . . 0.0 110.931 179.817 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.438 ' CB ' ' O ' ' A' ' 57' ' ' GLY . 1.1 tmm? 77.72 95.91 0.06 Allowed 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.708 179.581 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 19.9 tp10 -174.06 34.25 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.18 179.754 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -69.63 -20.91 63.59 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.957 -179.291 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 77.9 p -69.17 -43.55 74.03 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.958 -179.679 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.25 -35.79 81.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.266 179.764 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 87.0 t -66.97 -51.84 50.35 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.232 0 C-N-CA 120.727 -0.389 . . . . 0.0 110.433 -179.729 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 51.7 m -55.24 -44.04 75.14 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.53 -0.468 . . . . 0.0 110.358 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' HIS . . . . . 0.408 ' O ' HG22 ' A' ' 69' ' ' VAL . 33.7 m80 -68.42 -44.1 75.73 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.033 179.733 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 64.9 mt-30 -60.77 -40.62 93.18 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.381 -179.693 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -68.06 -39.85 82.88 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 120.975 0.417 . . . . 0.0 110.561 179.141 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 17.5 tpt85 -58.81 -47.19 85.64 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.617 -178.916 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.605 HG23 ' N ' ' A' ' 70' ' ' LEU . 27.6 m -75.24 -53.05 17.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.525 179.902 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.605 ' N ' HG23 ' A' ' 69' ' ' VAL . 69.5 mt -52.94 -38.97 62.5 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 -179.612 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 78.4 ttt180 -68.45 -42.37 78.91 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.481 178.919 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 9.1 m120 -60.08 -52.41 65.47 Favored 'General case' 0 C--N 1.333 -0.126 0 C-N-CA 120.646 -0.422 . . . . 0.0 110.426 -179.476 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.535 HD22 ' N ' ' A' ' 73' ' ' LEU . 3.9 mm? -67.28 -39.95 86.09 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.679 178.954 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 96.61 98.55 1.89 Allowed Glycine 0 CA--C 1.523 0.575 0 N-CA-C 110.938 -0.865 . . . . 0.0 110.938 -179.493 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.9 tp -163.05 -7.39 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.816 0.341 . . . . 0.0 110.76 179.869 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 33.6 m -140.61 163.37 22.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.271 -179.867 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.403 HG23 ' CD2' ' A' ' 90' ' ' TYR . 37.1 t -139.96 154.39 23.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.443 179.796 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -143.45 152.2 23.91 Favored Glycine 0 CA--C 1.522 0.486 0 N-CA-C 110.802 -0.919 . . . . 0.0 110.802 179.323 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ASP . . . . . 0.452 ' OD1' ' N ' ' A' ' 79' ' ' ASP . 3.9 p-10 . . . . . 0 N--CA 1.465 0.324 0 CA-C-O 120.667 0.27 . . . . 0.0 110.327 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 48.0 t . . . . . 0 N--CA 1.464 0.225 0 CA-C-O 120.858 0.361 . . . . 0.0 111.066 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 8.6 m-85 -108.27 126.08 52.41 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.076 178.904 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 38.6 m -148.65 166.72 27.49 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.365 -179.832 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 10.8 mt -61.65 152.42 30.85 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.272 -179.464 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.403 ' CD2' HG23 ' A' ' 77' ' ' VAL . 6.9 t80 -54.6 -49.43 70.48 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.43 -179.349 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 81.5 m-20 -130.99 -180.0 5.66 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 121.018 0.437 . . . . 0.0 110.373 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' THR . . . . . 0.586 ' O ' ' HB3' ' A' ' 95' ' ' ALA . 19.1 m -95.37 -18.15 20.99 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.44 -179.879 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 93' ' ' HIS . . . . . 0.507 ' CG ' ' ND1' ' B' ' 223' ' ' HIS . 42.8 m80 -43.46 -63.85 0.75 Allowed 'General case' 0 C--O 1.236 0.373 0 CA-C-O 120.978 0.418 . . . . 0.0 110.413 179.775 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 29.5 m -48.7 -35.02 6.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.189 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.586 ' HB3' ' O ' ' A' ' 92' ' ' THR . . . -64.41 -37.65 88.25 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.231 179.317 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.423 ' O ' ' OE2' ' A' ' 100' ' ' GLU . 99.1 mm-40 -63.17 -46.11 88.69 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 116.159 -0.473 . . . . 0.0 109.99 -179.894 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.804 HD21 ' HB2' ' B' ' 220' ' ' ALA . 9.0 mp -61.7 -43.52 98.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.133 -179.705 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 38.1 tp -65.47 -36.92 85.31 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.322 179.622 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' ASP . . . . . 0.548 ' CG ' HH21 ' A' ' 43' ' ' ARG . 94.7 m-20 -60.1 -45.5 92.75 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.113 -0.494 . . . . 0.0 109.895 -179.527 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.528 ' N ' ' OE1' ' A' ' 100' ' ' GLU . 0.4 OUTLIER -65.41 -53.24 45.95 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.284 -0.416 . . . . 0.0 109.997 179.586 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 101' ' ' ALA . . . . . 0.751 ' HB2' HD21 ' B' ' 216' ' ' LEU . . . -53.24 -43.51 67.39 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.559 -0.456 . . . . 0.0 110.221 179.41 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 3.7 mm -60.59 -47.9 90.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 C-N-CA 120.369 -0.532 . . . . 0.0 110.516 -178.82 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -63.02 -40.12 96.81 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.391 -179.759 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' HIS . . . . . 0.443 ' ND1' ' CG ' ' B' ' 212' ' ' HIS . 81.3 t60 -60.21 -47.15 87.16 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.744 -179.65 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 11.0 t -74.34 -38.56 63.22 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.107 0.48 . . . . 0.0 111.222 179.76 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 81.9 tt0 -59.15 -39.09 81.32 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.793 -179.069 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 57.3 t-80 . . . . . 0 N--CA 1.454 -0.242 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.215 -179.343 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 135' ' ' ASP . . . . . 0.481 ' N ' ' OD1' ' B' ' 135' ' ' ASP . 26.5 p-10 . . . . . 0 N--CA 1.464 0.226 0 CA-C-O 120.929 0.395 . . . . 0.0 110.841 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 136' ' ' SER . . . . . 0.445 ' N ' ' OD1' ' B' ' 135' ' ' ASP . 89.8 p -52.98 -50.59 63.84 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.293 179.098 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 11.2 tp-100 -61.5 -44.22 97.47 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 109.851 -0.425 . . . . 0.0 109.851 179.786 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 138' ' ' ALA . . . . . 0.522 ' O ' HG23 ' B' ' 142' ' ' VAL . . . -58.14 -29.24 65.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.23 179.763 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -72.57 -52.45 15.48 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 121.032 0.444 . . . . 0.0 110.395 179.714 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -64.75 -40.25 94.98 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.95 179.823 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 59.0 tt0 -64.6 -53.18 51.78 Favored 'General case' 0 C--O 1.241 0.642 0 CA-C-O 121.349 0.595 . . . . 0.0 110.859 -179.6 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 142' ' ' VAL . . . . . 0.522 HG23 ' O ' ' B' ' 138' ' ' ALA . 96.8 t -62.76 -44.49 99.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.051 179.645 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -53.72 -43.97 69.46 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 179.717 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 14.8 t -57.99 -44.42 87.13 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 179.835 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 9.9 m -63.2 -45.64 90.74 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.102 178.996 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 96.2 mt -64.32 -22.56 66.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.524 179.583 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 147' ' ' GLN . . . . . 0.501 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 55.1 tt0 -75.02 -55.71 5.47 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.289 179.357 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -58.09 -55.58 33.16 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.371 -179.803 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.505 ' O ' ' O ' ' B' ' 150' ' ' ALA . 93.6 mt -45.41 -35.88 3.96 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.342 -179.557 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 150' ' ' ALA . . . . . 0.505 ' O ' ' O ' ' B' ' 149' ' ' LEU . . . -56.45 -139.76 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 O-C-N 123.56 0.537 . . . . 0.0 110.518 179.5 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 151' ' ' THR . . . . . 0.449 ' O ' ' O ' ' B' ' 150' ' ' ALA . 95.7 m 57.37 114.49 0.02 OUTLIER Pre-proline 0 C--N 1.323 -0.558 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.293 179.947 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -48.99 -47.76 20.52 Favored 'Trans proline' 0 N--CA 1.493 1.474 0 C-N-CA 122.292 1.995 . . . . 0.0 112.819 -179.042 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 67.9 m -61.91 -46.78 87.88 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.29 -179.022 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 3.2 tpp180 -62.61 -47.37 84.06 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.403 -178.919 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 155' ' ' LEU . . . . . 0.591 HD23 ' O ' ' B' ' 155' ' ' LEU . 2.7 tt -60.74 -52.96 62.88 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.43 -178.571 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 63.0 ttp -50.42 -48.06 56.33 Favored 'General case' 0 C--O 1.238 0.488 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.243 179.718 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 5.9 mm -62.71 -44.0 99.11 Favored 'Isoleucine or valine' 0 C--O 1.238 0.497 0 CA-C-O 121.019 0.437 . . . . 0.0 110.623 179.839 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 63.3 mt -61.73 -41.7 97.99 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.532 179.541 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 9.9 m -58.0 -40.05 79.8 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.71 179.572 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -63.05 -44.35 96.08 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.826 -0.35 . . . . 0.0 110.421 179.417 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 161' ' ' LEU . . . . . 0.466 ' O ' ' N ' ' B' ' 163' ' ' ASN . 76.7 mt -62.83 -31.76 72.83 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.142 179.502 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 162' ' ' ARG . . . . . 0.524 HH21 ' CG ' ' B' ' 218' ' ' ASP . 33.4 tpt85 -34.58 -33.69 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 O-C-N 123.548 0.53 . . . . 0.0 110.959 -179.612 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 163' ' ' ASN . . . . . 0.466 ' N ' ' O ' ' B' ' 161' ' ' LEU . 86.9 m-20 -70.13 -83.0 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.293 179.671 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . 147.92 -76.05 0.26 Allowed Glycine 0 CA--C 1.525 0.675 0 N-CA-C 110.933 -0.867 . . . . 0.0 110.933 179.921 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -68.36 84.41 0.47 Allowed 'Trans proline' 0 N--CA 1.496 1.62 0 C-N-CA 122.71 2.274 . . . . 0.0 112.298 -179.721 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -157.02 66.72 3.99 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.101 0.477 . . . . 0.0 110.169 -179.552 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -44.51 171.36 0.02 OUTLIER 'Trans proline' 0 C--N 1.299 -2.053 0 C-N-CA 122.452 2.101 . . . . 0.0 112.143 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . 83.0 t -54.26 -46.57 68.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.324 -179.409 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 169' ' ' THR . . . . . . . . . . . . . 12.6 m -61.6 -37.81 85.29 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.274 0.559 . . . . 0.0 110.417 179.272 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -67.01 -40.55 87.32 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.133 179.78 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 171' ' ' LEU . . . . . 0.624 ' O ' HD13 ' B' ' 171' ' ' LEU . 0.2 OUTLIER -62.73 -42.07 99.49 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.9 -179.933 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 172' ' ' ALA . . . . . 0.575 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -56.54 -48.47 77.22 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 179.406 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -54.56 -43.95 72.48 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.013 179.592 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -56.95 -55.85 29.29 Favored 'General case' 0 C--O 1.232 0.154 0 C-N-CA 120.696 -0.402 . . . . 0.0 110.687 179.698 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 89.7 mt -81.97 -68.66 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.299 179.497 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 176' ' ' GLY . . . . . 0.575 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 132.33 72.71 0.1 OUTLIER Glycine 0 CA--C 1.52 0.37 0 N-CA-C 110.962 -0.855 . . . . 0.0 110.962 179.742 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 177' ' ' MET . . . . . 0.474 ' CB ' ' O ' ' B' ' 176' ' ' GLY . 1.2 tmm? 79.86 96.47 0.06 Allowed 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 120.914 -0.314 . . . . 0.0 110.794 179.517 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -174.5 34.18 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.202 179.799 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -68.54 -23.29 64.51 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.899 -179.484 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 69.8 p -66.45 -44.88 81.6 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.055 -179.75 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -62.59 -34.99 78.11 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.382 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 97.9 t -66.98 -52.34 45.01 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.225 0 C-N-CA 120.602 -0.439 . . . . 0.0 110.509 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 50.0 m -55.21 -43.89 74.85 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.57 -0.452 . . . . 0.0 110.455 -179.684 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 184' ' ' HIS . . . . . 0.453 ' O ' HG22 ' B' ' 188' ' ' VAL . 77.7 m-70 -67.78 -42.91 80.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.034 179.756 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 69.7 mt-30 -62.74 -39.97 95.77 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.338 -179.848 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -67.93 -40.59 83.3 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 120.993 0.425 . . . . 0.0 110.592 178.871 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 16.8 tpt85 -58.65 -46.31 87.41 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.712 -178.737 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 188' ' ' VAL . . . . . 0.595 HG23 ' N ' ' B' ' 189' ' ' LEU . 29.4 m -75.85 -52.59 17.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.537 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 189' ' ' LEU . . . . . 0.595 ' N ' HG23 ' B' ' 188' ' ' VAL . 72.1 mt -53.53 -39.91 65.07 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.161 -0.472 . . . . 0.0 109.746 -179.793 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 77.3 ttt180 -67.16 -43.18 82.93 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.453 179.038 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -59.35 -51.66 68.95 Favored 'General case' 0 C--O 1.23 0.071 0 C-N-CA 120.553 -0.459 . . . . 0.0 110.395 -179.407 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 192' ' ' LEU . . . . . 0.498 ' N ' HD22 ' B' ' 192' ' ' LEU . 4.1 mm? -68.12 -39.34 82.79 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.83 178.97 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 96.05 97.89 1.81 Allowed Glycine 0 CA--C 1.522 0.522 0 N-CA-C 110.915 -0.874 . . . . 0.0 110.915 -179.58 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 194' ' ' LEU . . . . . 0.414 ' H ' ' H ' ' B' ' 195' ' ' VAL . 4.2 tp -162.19 -9.0 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.904 0.383 . . . . 0.0 110.716 179.791 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 195' ' ' VAL . . . . . 0.414 ' H ' ' H ' ' B' ' 194' ' ' LEU . 34.4 m -139.42 161.65 27.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.382 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 196' ' ' VAL . . . . . 0.422 HG23 ' CD2' ' B' ' 209' ' ' TYR . 41.1 t -139.8 154.52 24.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 121.043 0.449 . . . . 0.0 110.473 179.892 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 197' ' ' GLY . . . . . 0.402 ' N ' ' CG1' ' B' ' 196' ' ' VAL . . . -143.21 153.09 24.56 Favored Glycine 0 CA--C 1.519 0.334 0 N-CA-C 111.002 -0.839 . . . . 0.0 111.002 179.505 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 198' ' ' ASP . . . . . 0.434 ' N ' ' OD1' ' B' ' 198' ' ' ASP . 5.8 p-10 . . . . . 0 N--CA 1.464 0.247 0 CA-C-O 120.83 0.348 . . . . 0.0 110.456 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 58.8 t . . . . . 0 N--CA 1.463 0.187 0 CA-C-O 120.979 0.419 . . . . 0.0 110.686 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -107.24 129.81 54.82 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.655 179.207 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 49.2 m -150.59 168.56 23.9 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.361 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 208' ' ' LEU . . . . . 0.403 ' H ' ' HG ' ' B' ' 208' ' ' LEU . 18.1 mt -63.21 152.12 38.45 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.376 -179.65 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 209' ' ' TYR . . . . . 0.422 ' CD2' HG23 ' B' ' 196' ' ' VAL . 6.4 t80 -55.04 -48.71 73.07 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.368 -179.343 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 84.3 m-20 -132.88 177.84 7.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.936 0.398 . . . . 0.0 110.402 -179.909 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 211' ' ' THR . . . . . 0.625 ' O ' ' HB3' ' B' ' 214' ' ' ALA . 24.3 m -92.83 -20.02 21.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.457 -179.843 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 212' ' ' HIS . . . . . 0.443 ' CG ' ' ND1' ' A' ' 104' ' ' HIS . 38.3 m80 -41.24 -65.44 0.43 Allowed 'General case' 0 C--O 1.237 0.429 0 CA-C-O 120.912 0.387 . . . . 0.0 110.557 179.876 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 22.8 m -47.88 -34.06 4.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.199 179.888 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 214' ' ' ALA . . . . . 0.625 ' HB3' ' O ' ' B' ' 211' ' ' THR . . . -65.04 -38.34 90.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.255 179.205 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 215' ' ' GLN . . . . . 0.412 ' O ' ' OE2' ' B' ' 219' ' ' GLU . 99.4 mm-40 -62.09 -46.99 86.64 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 121.056 0.455 . . . . 0.0 110.095 -179.908 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 216' ' ' LEU . . . . . 0.751 HD21 ' HB2' ' A' ' 101' ' ' ALA . 8.0 mp -61.01 -42.64 98.84 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.27 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 217' ' ' LEU . . . . . 0.402 HD12 ' HA ' ' B' ' 217' ' ' LEU . 45.7 tp -65.86 -37.34 85.93 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.383 179.523 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 218' ' ' ASP . . . . . 0.524 ' CG ' HH21 ' B' ' 162' ' ' ARG . 99.5 m-20 -59.9 -43.8 94.63 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.17 -0.468 . . . . 0.0 109.957 -179.469 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 219' ' ' GLU . . . . . 0.497 ' OE1' ' N ' ' B' ' 219' ' ' GLU . 0.6 OUTLIER -67.94 -52.12 39.74 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.15 179.344 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 220' ' ' ALA . . . . . 0.804 ' HB2' HD21 ' A' ' 97' ' ' LEU . . . -53.22 -44.22 67.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.166 179.477 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 4.9 mm -61.61 -45.9 97.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 C-N-CA 120.312 -0.555 . . . . 0.0 110.876 -179.34 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -63.36 -39.82 95.57 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.499 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 223' ' ' HIS . . . . . 0.507 ' ND1' ' CG ' ' A' ' 93' ' ' HIS . 81.5 t60 -60.85 -46.77 89.28 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.728 -179.832 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 10.5 t -73.91 -39.81 63.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.156 179.65 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -56.94 -40.19 75.92 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.653 -179.252 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 53.2 t-80 . . . . . 0 N--CA 1.455 -0.216 0 C-N-CA 120.568 -0.453 . . . . 0.0 110.338 -179.181 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 . . . . . 0 C--O 1.236 0.389 0 CA-C-O 121.294 0.568 . . . . 0.0 110.994 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 93.4 p -58.77 -33.67 70.57 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.279 -179.424 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 54.3 mt-30 -68.59 -48.22 64.73 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.439 179.52 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.5 ' O ' HG23 ' A' ' 23' ' ' VAL . . . -55.68 -38.42 69.6 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 -179.81 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.64 -53.13 45.68 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 120.996 0.427 . . . . 0.0 110.259 179.606 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.98 -43.37 95.16 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 120.702 -0.399 . . . . 0.0 110.842 -179.859 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -64.17 -53.13 54.28 Favored 'General case' 0 C--O 1.242 0.665 0 CA-C-O 121.394 0.616 . . . . 0.0 111.045 -179.463 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.5 HG23 ' O ' ' A' ' 19' ' ' ALA . 96.0 t -61.73 -45.48 98.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.183 179.801 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.13 -41.3 83.39 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 179.853 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 45.6 t -57.08 -45.33 83.42 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 -179.724 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.428 ' OG1' ' O ' ' A' ' 23' ' ' VAL . 20.8 p -65.56 -44.68 86.02 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 120.755 -0.378 . . . . 0.0 110.497 178.97 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 96.1 mt -64.42 -23.72 67.38 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.661 179.482 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.51 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 57.0 tt0 -75.14 -57.38 3.93 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.54 179.543 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.26 -54.55 45.77 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 120.61 -0.436 . . . . 0.0 110.466 -179.417 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.489 ' O ' ' O ' ' A' ' 31' ' ' ALA . 88.7 mt -46.08 -34.62 4.27 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.27 -179.55 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.51 ' HB3' ' O ' ' A' ' 28' ' ' GLN . . . -57.03 -129.44 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 O-C-N 123.642 0.589 . . . . 0.0 110.364 179.437 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.467 ' HG1' ' HB2' ' A' ' 35' ' ' ARG . 0.3 OUTLIER 52.8 108.31 0.02 OUTLIER Pre-proline 0 CA--C 1.54 0.572 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.331 179.561 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_exo -45.8 -59.91 1.03 Allowed 'Trans proline' 0 C--N 1.309 -1.523 0 C-N-CA 122.166 1.91 . . . . 0.0 112.882 -179.217 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 50.8 m -54.86 -45.7 74.61 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.869 -178.622 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.467 ' HB2' ' HG1' ' A' ' 32' ' ' THR . 46.0 mmm-85 -61.79 -44.76 96.23 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.027 -179.582 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.594 HD23 ' O ' ' A' ' 36' ' ' LEU . 2.0 tt -63.11 -49.0 76.16 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.423 -179.342 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 28.6 ttt -52.1 -48.53 64.72 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.242 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 38.2 mm -63.63 -43.4 98.14 Favored 'Isoleucine or valine' 0 C--O 1.244 0.801 0 CA-C-O 121.189 0.519 . . . . 0.0 110.574 179.542 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 15.7 tp -61.76 -41.28 97.48 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.225 -179.55 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 19.6 m -61.27 -42.41 98.58 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 179.364 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 10.6 tp-100 -54.34 -48.06 71.84 Favored 'General case' 0 C--O 1.233 0.19 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 17.2 mt -64.29 -40.15 95.38 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.509 -0.476 . . . . 0.0 111.087 178.774 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.405 HH21 HD13 ' A' ' 98' ' ' LEU . 30.1 ttm180 -46.03 -25.51 0.58 Allowed 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.35 -179.186 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 97.8 m-20 -61.59 -39.84 92.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.582 -179.94 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 157.66 -176.89 34.67 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.911 -0.876 . . . . 0.0 110.911 179.846 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -78.35 117.9 4.17 Favored 'Trans proline' 0 C--N 1.309 -1.501 0 C-N-CA 122.885 2.39 . . . . 0.0 111.67 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.541 HD12 ' O ' ' A' ' 47' ' ' LEU . 0.3 OUTLIER -148.75 128.25 6.39 Favored Pre-proline 0 CA--C 1.543 0.693 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.368 -179.58 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -47.53 167.28 0.09 OUTLIER 'Trans proline' 0 C--N 1.307 -1.613 0 C-N-CA 122.266 1.978 . . . . 0.0 112.475 178.745 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.424 ' CG2' ' N ' ' A' ' 50' ' ' THR . 2.4 m -61.06 -37.36 77.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-O 121.586 0.708 . . . . 0.0 110.518 179.91 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.424 ' N ' ' CG2' ' A' ' 49' ' ' VAL . 26.9 m -59.99 -44.93 94.19 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 115.029 -0.987 . . . . 0.0 110.386 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 55.4 m-20 -66.21 -39.33 89.55 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.122 178.992 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.652 HD23 ' O ' ' A' ' 52' ' ' LEU . 4.8 tt -61.55 -42.51 98.94 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.795 -179.886 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.563 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -60.75 -43.85 97.45 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 179.719 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -55.14 -44.79 75.4 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.63 -0.428 . . . . 0.0 109.878 179.789 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -62.53 -39.67 94.33 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.731 -0.388 . . . . 0.0 110.602 179.622 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.504 HD12 ' CD2' ' A' ' 52' ' ' LEU . 90.9 mt -94.38 -78.08 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.239 179.577 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' GLY . . . . . 0.563 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 150.11 83.55 0.04 OUTLIER Glycine 0 CA--C 1.521 0.408 0 N-CA-C 111.663 -0.575 . . . . 0.0 111.663 179.622 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.407 ' O ' ' OE1' ' A' ' 59' ' ' GLU . 87.1 mtp 57.49 103.32 0.02 OUTLIER 'General case' 0 CA--C 1.518 -0.283 0 CA-C-O 121.015 0.436 . . . . 0.0 111.047 179.008 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.407 ' OE1' ' O ' ' A' ' 58' ' ' MET . 3.6 tp10 -174.86 32.74 0.01 OUTLIER 'General case' 0 N--CA 1.456 -0.132 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.298 179.78 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 -63.1 -23.85 67.63 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.057 -178.907 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 78.0 p -71.06 -43.73 67.19 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.087 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.403 ' O ' ' NE2' ' A' ' 66' ' ' GLN . . . -64.07 -29.7 70.82 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.174 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 92.4 t -74.45 -52.07 20.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 C-N-CA 120.809 -0.356 . . . . 0.0 110.615 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 67.9 p -56.03 -45.43 79.16 Favored 'General case' 0 C--O 1.233 0.192 0 C-N-CA 120.533 -0.467 . . . . 0.0 110.651 -179.77 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 34.0 m80 -66.25 -50.9 62.17 Favored 'General case' 0 C--O 1.242 0.662 0 CA-C-O 121.171 0.51 . . . . 0.0 111.235 -179.866 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' GLN . . . . . 0.403 ' NE2' ' O ' ' A' ' 62' ' ' ALA . 28.6 mt-30 -58.34 -31.56 67.69 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.245 179.458 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.416 ' O ' ' CG ' ' A' ' 71' ' ' ARG . 5.1 tp -69.65 -43.39 72.71 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.446 179.931 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 82.3 mtp180 -60.19 -49.75 76.4 Favored 'General case' 0 C--O 1.245 0.843 0 CA-C-O 121.512 0.673 . . . . 0.0 111.167 -179.298 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.593 HG13 ' N ' ' A' ' 70' ' ' LEU . 4.4 p -66.2 -54.55 25.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.349 179.523 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.593 ' N ' HG13 ' A' ' 69' ' ' VAL . 70.8 mt -54.17 -35.23 62.07 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 -179.65 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.416 ' CG ' ' O ' ' A' ' 67' ' ' LEU . 11.9 mmm180 -61.78 -40.46 95.29 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.651 179.148 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -62.78 -42.97 99.93 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.075 -179.799 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.485 HD23 ' N ' ' A' ' 73' ' ' LEU . 6.9 mt -67.61 -42.34 82.57 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.422 -179.496 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 100.9 37.54 3.63 Favored Glycine 0 CA--C 1.522 0.483 0 N-CA-C 111.22 -0.752 . . . . 0.0 111.22 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -100.43 -15.37 17.95 Favored 'General case' 0 CA--C 1.512 -0.483 0 O-C-N 122.825 -0.221 . . . . 0.0 110.897 179.534 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 23.2 m -136.57 158.58 37.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-O 120.846 0.355 . . . . 0.0 110.049 -179.815 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.432 ' CG1' ' N ' ' A' ' 78' ' ' GLY . 40.1 t -142.48 156.53 18.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.622 179.836 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' GLY . . . . . 0.432 ' N ' ' CG1' ' A' ' 77' ' ' VAL . . . -105.13 167.68 15.18 Favored Glycine 0 CA--C 1.522 0.524 0 N-CA-C 110.309 -1.116 . . . . 0.0 110.309 179.555 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 68.0 t0 . . . . . 0 C--N 1.329 -0.289 0 CA-C-O 120.602 0.239 . . . . 0.0 110.568 -179.374 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.41 HG12 ' N ' ' A' ' 87' ' ' TYR . 18.6 t . . . . . 0 C--O 1.224 -0.262 0 CA-C-O 120.732 0.301 . . . . 0.0 110.403 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.41 ' N ' HG12 ' A' ' 86' ' ' VAL . 44.2 m-85 -106.0 136.64 45.3 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.532 -179.496 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 94.8 p -151.91 172.7 15.82 Favored 'General case' 0 C--O 1.224 -0.289 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.423 -179.798 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 56.3 mt -65.41 148.2 52.12 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.656 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.413 ' CD2' HG23 ' A' ' 77' ' ' VAL . 10.2 t80 -52.71 -48.5 66.59 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.312 -179.456 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 46.5 p-10 -146.77 -179.78 7.03 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.781 0.324 . . . . 0.0 110.555 -179.857 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' THR . . . . . 0.453 ' O ' ' HB3' ' A' ' 95' ' ' ALA . 42.0 p -88.7 -16.34 32.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.558 -179.844 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 58.4 m80 -46.88 -65.38 0.57 Allowed 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.048 0.452 . . . . 0.0 110.697 -179.872 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 11.9 p -52.79 -35.25 21.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.193 -179.779 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.453 ' HB3' ' O ' ' A' ' 92' ' ' THR . . . -62.97 -40.35 97.44 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.411 179.493 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -63.55 -44.45 94.12 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 116.013 -0.54 . . . . 0.0 109.895 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 13.9 tp -60.02 -42.71 94.94 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.158 -179.835 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.405 HD13 HH21 ' A' ' 43' ' ' ARG . 87.5 mt -63.39 -39.2 93.87 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.154 179.801 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -60.28 -42.86 96.33 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.103 -179.831 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 73.8 mm-40 -67.72 -47.69 68.64 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.542 179.617 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.14 -44.29 92.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.262 -0.426 . . . . 0.0 109.949 179.684 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 5.0 mm -62.94 -44.13 99.43 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.639 -179.561 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -60.08 -42.19 94.07 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.998 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 35.0 m170 -68.77 -35.96 77.72 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.245 179.788 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 7.0 t -59.02 -47.98 83.25 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.322 -179.692 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -74.8 -57.28 4.01 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.003 0.43 . . . . 0.0 110.431 179.465 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 53.3 m170 . . . . . 0 C--N 1.331 -0.229 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.043 -179.867 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 . . . . . 0 N--CA 1.466 0.37 0 CA-C-O 120.963 0.411 . . . . 0.0 110.591 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 11.2 t -59.14 -48.79 80.32 Favored 'General case' 0 C--O 1.24 0.585 0 CA-C-O 121.189 0.519 . . . . 0.0 110.711 178.933 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 73.8 mt-30 -64.53 -42.78 95.55 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.948 -179.881 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 138' ' ' ALA . . . . . 0.492 ' O ' HG23 ' B' ' 142' ' ' VAL . . . -55.83 -38.86 70.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.08 -179.891 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -65.36 -53.25 46.25 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 120.933 0.396 . . . . 0.0 110.242 179.552 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -60.52 -41.85 95.22 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.532 -0.467 . . . . 0.0 110.879 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 59.5 tt0 -64.35 -53.71 44.43 Favored 'General case' 0 C--O 1.244 0.773 0 CA-C-O 121.415 0.626 . . . . 0.0 111.025 -179.573 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 142' ' ' VAL . . . . . 0.492 HG23 ' O ' ' B' ' 138' ' ' ALA . 89.4 t -62.17 -45.68 98.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.006 179.684 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -57.27 -42.09 80.97 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 44.2 t -56.58 -45.84 81.11 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 -179.725 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 145' ' ' THR . . . . . 0.458 ' OG1' ' O ' ' B' ' 142' ' ' VAL . 21.7 p -65.16 -44.02 89.89 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 120.65 -0.42 . . . . 0.0 110.54 179.078 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 95.9 mt -64.37 -24.05 67.5 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.598 179.455 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 147' ' ' GLN . . . . . 0.506 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 55.9 tt0 -75.38 -57.05 4.13 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.536 179.607 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -57.95 -54.67 44.32 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.599 -179.32 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.501 ' O ' ' O ' ' B' ' 150' ' ' ALA . 92.9 mt -46.29 -35.56 5.43 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.319 -179.66 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 150' ' ' ALA . . . . . 0.506 ' HB3' ' O ' ' B' ' 147' ' ' GLN . . . -56.69 -131.43 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.262 0.553 . . . . 0.0 110.407 179.6 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 151' ' ' THR . . . . . 0.532 ' HG1' ' HB2' ' B' ' 154' ' ' ARG . 0.4 OUTLIER 54.61 108.61 0.02 OUTLIER Pre-proline 0 CA--C 1.539 0.539 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.322 179.503 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -45.58 -61.45 0.59 Allowed 'Trans proline' 0 C--N 1.31 -1.494 0 C-N-CA 122.304 2.003 . . . . 0.0 112.868 -179.11 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 49.6 m -53.96 -46.7 71.69 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.0 -178.591 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 154' ' ' ARG . . . . . 0.532 ' HB2' ' HG1' ' B' ' 151' ' ' THR . 46.0 mmm-85 -60.46 -44.09 96.23 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 120.716 -0.394 . . . . 0.0 111.011 -179.502 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 155' ' ' LEU . . . . . 0.59 HD23 ' O ' ' B' ' 155' ' ' LEU . 1.9 tt -64.18 -49.16 73.14 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.31 -179.389 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 28.6 ttt -51.61 -49.05 62.93 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.241 -179.459 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 42.8 mm -64.24 -43.69 97.3 Favored 'Isoleucine or valine' 0 C--O 1.247 0.931 0 CA-C-O 121.188 0.518 . . . . 0.0 110.437 179.737 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 17.6 tp -60.84 -42.1 97.11 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.262 -179.516 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 19.0 m -61.57 -41.59 97.62 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.858 179.383 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 10.4 tp-100 -53.45 -49.29 67.7 Favored 'General case' 0 C--O 1.233 0.202 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 161' ' ' LEU . . . . . 0.464 ' O ' ' N ' ' B' ' 163' ' ' ASN . 8.9 mt -64.29 -40.65 96.39 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.288 -0.565 . . . . 0.0 111.153 179.054 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 162' ' ' ARG . . . . . 0.462 HH21 HD13 ' B' ' 217' ' ' LEU . 32.6 ttm180 -42.14 -23.56 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.287 -179.213 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 163' ' ' ASN . . . . . 0.464 ' N ' ' O ' ' B' ' 161' ' ' LEU . 91.4 m-20 -63.06 -41.46 99.46 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.624 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 164' ' ' GLY . . . . . 0.401 ' N ' ' O ' ' B' ' 161' ' ' LEU . . . 155.83 -170.36 33.65 Favored Glycine 0 CA--C 1.522 0.484 0 N-CA-C 111.09 -0.804 . . . . 0.0 111.09 179.523 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -74.24 120.27 6.2 Favored 'Trans proline' 0 N--CA 1.495 1.594 0 C-N-CA 122.916 2.411 . . . . 0.0 111.849 179.848 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 166' ' ' LEU . . . . . 0.5 ' O ' HD12 ' B' ' 166' ' ' LEU . 0.2 OUTLIER -151.92 120.91 3.39 Favored Pre-proline 0 CA--C 1.545 0.768 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.633 179.843 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -47.6 168.67 0.07 OUTLIER 'Trans proline' 0 C--N 1.304 -1.788 0 C-N-CA 122.26 1.974 . . . . 0.0 112.317 178.633 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 168' ' ' VAL . . . . . 0.438 HG13 ' H ' ' B' ' 168' ' ' VAL . 2.6 m -60.46 -37.75 75.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-O 121.698 0.761 . . . . 0.0 110.41 179.875 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 169' ' ' THR . . . . . 0.42 ' N ' ' CG2' ' B' ' 168' ' ' VAL . 14.0 m -60.7 -45.65 93.37 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 115.058 -0.973 . . . . 0.0 110.192 -179.944 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 71.5 m-20 -65.11 -41.15 95.17 Favored 'General case' 0 C--O 1.241 0.639 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.077 179.314 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 171' ' ' LEU . . . . . 0.59 HD23 ' O ' ' B' ' 171' ' ' LEU . 4.5 tt -61.32 -41.71 97.46 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.936 -179.541 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 172' ' ' ALA . . . . . 0.549 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -60.77 -44.03 97.28 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 179.649 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -55.26 -44.52 75.66 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.275 -0.42 . . . . 0.0 109.897 179.773 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -61.92 -41.04 97.47 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.47 179.623 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 175' ' ' ILE . . . . . 0.482 HD12 ' CD2' ' B' ' 171' ' ' LEU . 96.7 mt -93.52 -79.04 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.183 179.486 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 176' ' ' GLY . . . . . 0.549 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 151.84 82.43 0.04 OUTLIER Glycine 0 CA--C 1.52 0.388 0 N-CA-C 111.518 -0.633 . . . . 0.0 111.518 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 177' ' ' MET . . . . . 0.435 ' O ' ' OE1' ' B' ' 178' ' ' GLU . 89.0 mtp 58.34 105.37 0.02 OUTLIER 'General case' 0 CA--C 1.518 -0.253 0 CA-C-O 120.853 0.359 . . . . 0.0 110.995 179.076 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 178' ' ' GLU . . . . . 0.435 ' OE1' ' O ' ' B' ' 177' ' ' MET . 4.0 tp10 -176.87 32.75 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.28 179.75 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 7.5 mt-30 -62.84 -23.8 67.46 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.031 -179.005 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 78.7 p -70.95 -42.45 69.79 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.968 -179.697 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -65.71 -28.91 69.4 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.299 -179.898 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 97.9 t -74.8 -52.47 19.14 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.126 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.547 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 79.4 p -56.32 -43.8 79.34 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 120.541 -0.464 . . . . 0.0 110.366 -179.699 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 64.5 m-70 -66.84 -50.93 60.99 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-O 121.163 0.506 . . . . 0.0 111.078 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -58.8 -31.48 68.46 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.214 179.507 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 186' ' ' LEU . . . . . 0.415 ' O ' ' CG ' ' B' ' 190' ' ' ARG . 5.1 tp -69.77 -43.46 72.15 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.549 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 81.3 mtp180 -60.02 -49.17 78.71 Favored 'General case' 0 C--O 1.246 0.876 0 CA-C-O 121.293 0.568 . . . . 0.0 111.144 -179.376 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 188' ' ' VAL . . . . . 0.588 HG13 ' N ' ' B' ' 189' ' ' LEU . 4.9 p -67.05 -54.39 24.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.243 179.726 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 189' ' ' LEU . . . . . 0.588 ' N ' HG13 ' B' ' 188' ' ' VAL . 73.4 mt -54.21 -35.63 62.6 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 -179.657 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 190' ' ' ARG . . . . . 0.415 ' CG ' ' O ' ' B' ' 186' ' ' LEU . 12.6 mmm180 -61.36 -40.56 94.76 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.63 179.12 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -62.92 -42.58 99.85 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 120.37 -0.532 . . . . 0.0 109.969 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 192' ' ' LEU . . . . . 0.494 HD23 ' N ' ' B' ' 192' ' ' LEU . 7.2 mt -67.91 -38.29 82.78 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.42 -179.542 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 95.9 35.28 5.64 Favored Glycine 0 CA--C 1.521 0.427 0 N-CA-C 111.23 -0.748 . . . . 0.0 111.23 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -98.4 -15.89 19.5 Favored 'General case' 0 CA--C 1.512 -0.511 0 O-C-N 122.916 -0.167 . . . . 0.0 111.079 179.558 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 26.5 m -136.4 158.44 37.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.11 -179.832 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 196' ' ' VAL . . . . . 0.44 ' CG1' ' N ' ' B' ' 197' ' ' GLY . 41.2 t -142.77 156.76 18.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.595 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 197' ' ' GLY . . . . . 0.44 ' N ' ' CG1' ' B' ' 196' ' ' VAL . . . -106.08 168.69 15.13 Favored Glycine 0 CA--C 1.523 0.572 0 N-CA-C 110.418 -1.073 . . . . 0.0 110.418 179.6 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 67.9 t0 . . . . . 0 C--N 1.328 -0.345 0 CA-C-O 120.769 0.319 . . . . 0.0 110.559 -179.654 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 205' ' ' VAL . . . . . 0.448 HG12 ' N ' ' B' ' 206' ' ' TYR . 21.4 t . . . . . 0 N--CA 1.466 0.364 0 N-CA-C 110.391 -0.226 . . . . 0.0 110.391 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 206' ' ' TYR . . . . . 0.448 ' N ' HG12 ' B' ' 205' ' ' VAL . 45.0 m-85 -108.77 135.5 49.89 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.332 -179.668 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 83.5 p -151.56 172.06 16.62 Favored 'General case' 0 C--O 1.224 -0.289 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.429 -179.759 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . 55.3 mt -65.63 149.12 50.61 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.529 -179.764 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 209' ' ' TYR . . . . . 0.418 ' CD2' HG23 ' B' ' 196' ' ' VAL . 11.7 t80 -52.44 -48.72 65.61 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.326 -179.631 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 42.5 p-10 -146.74 -178.94 6.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.77 0.319 . . . . 0.0 110.559 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 211' ' ' THR . . . . . 0.476 ' O ' ' HB3' ' B' ' 214' ' ' ALA . 30.7 p -88.97 -17.04 30.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.374 -179.755 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 212' ' ' HIS . . . . . . . . . . . . . 46.3 m80 -45.12 -65.21 0.56 Allowed 'General case' 0 C--O 1.237 0.419 0 CA-C-O 121.045 0.45 . . . . 0.0 110.701 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 10.7 p -53.05 -35.64 23.05 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.178 -179.823 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 214' ' ' ALA . . . . . 0.476 ' HB3' ' O ' ' B' ' 211' ' ' THR . . . -62.09 -41.96 98.73 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.392 179.55 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -62.51 -45.12 94.43 Favored 'General case' 0 C--O 1.238 0.459 0 CA-C-N 116.172 -0.467 . . . . 0.0 109.894 -179.917 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 216' ' ' LEU . . . . . . . . . . . . . 18.4 tp -60.01 -42.38 94.16 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.06 -179.648 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 217' ' ' LEU . . . . . 0.462 HD13 HH21 ' B' ' 162' ' ' ARG . 79.1 mt -63.72 -39.76 95.1 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.306 179.745 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 97.0 m-20 -59.66 -42.91 93.89 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.176 -179.806 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 219' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -67.16 -49.11 65.89 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.779 -0.368 . . . . 0.0 110.634 179.446 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -57.69 -44.99 86.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.285 -0.416 . . . . 0.0 109.924 179.689 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 4.8 mm -62.34 -43.98 98.7 Favored 'Isoleucine or valine' 0 C--O 1.237 0.442 0 CA-C-O 121.148 0.499 . . . . 0.0 110.612 -179.457 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -60.68 -42.22 96.66 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.937 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 223' ' ' HIS . . . . . . . . . . . . . 46.7 m170 -68.88 -36.3 77.91 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.113 179.838 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 43.0 t -58.73 -47.71 83.65 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.262 -179.673 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -74.9 -57.22 4.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.993 0.425 . . . . 0.0 110.586 179.236 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 59.2 m170 . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.125 -179.809 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 95.0 m-20 . . . . . 0 C--O 1.239 0.55 0 CA-C-O 121.258 0.552 . . . . 0.0 110.802 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 37.7 t -57.55 -42.75 83.57 Favored 'General case' 0 C--O 1.239 0.547 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.124 -179.552 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 68.4 mm-40 -66.49 -42.66 87.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.28 179.521 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.527 ' O ' HG23 ' A' ' 23' ' ' VAL . . . -51.74 -48.11 63.77 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 -179.209 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.34 -53.98 49.69 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 120.387 -0.525 . . . . 0.0 110.308 179.07 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -52.6 -48.24 66.41 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.03 179.803 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 85.8 mm-40 -56.32 -50.03 72.61 Favored 'General case' 0 C--O 1.241 0.614 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.688 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.527 HG23 ' O ' ' A' ' 19' ' ' ALA . 84.2 t -60.12 -37.66 73.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.813 179.686 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.682 ' HB2' HD12 ' B' ' 155' ' ' LEU . . . -64.86 -42.07 95.16 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.411 178.945 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 67.1 m -56.9 -49.69 74.8 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.935 0.398 . . . . 0.0 110.99 -178.693 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.414 HG23 ' N ' ' A' ' 27' ' ' LEU . 1.4 t -65.65 -48.68 71.32 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.725 179.832 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.414 ' N ' HG23 ' A' ' 26' ' ' THR . 69.1 mt -62.01 -26.06 68.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.946 179.758 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.667 ' NE2' ' NE2' ' B' ' 147' ' ' GLN . 29.6 tp60 -72.88 -60.12 2.38 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.352 179.224 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -55.64 -53.97 49.9 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.714 -179.189 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.511 ' O ' ' O ' ' A' ' 31' ' ' ALA . 7.3 mp -46.56 -35.45 5.83 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.397 -179.192 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.511 ' O ' ' O ' ' A' ' 30' ' ' LEU . . . -57.47 -132.69 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.45 0 O-C-N 123.52 0.512 . . . . 0.0 110.022 179.468 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.47 ' O ' ' O ' ' A' ' 31' ' ' ALA . 0.8 OUTLIER 54.43 113.04 0.01 OUTLIER Pre-proline 0 CA--C 1.542 0.661 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.39 179.495 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -50.45 -57.58 2.2 Favored 'Trans proline' 0 N--CA 1.495 1.609 0 C-N-CA 122.283 1.989 . . . . 0.0 113.282 -179.541 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 80.5 p -52.8 -46.09 67.52 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.22 -178.175 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 10.7 mpt_? -61.97 -42.67 99.4 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.637 -179.61 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.697 HD12 ' HB2' ' B' ' 143' ' ' ALA . 5.1 mt -61.37 -51.92 66.8 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 120.35 -0.54 . . . . 0.0 110.841 -179.159 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 11.2 tpt -53.83 -49.35 68.59 Favored 'General case' 0 C--O 1.24 0.574 0 C-N-CA 120.279 -0.568 . . . . 0.0 110.224 -179.62 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 96.7 mt -62.88 -45.58 98.5 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 CA-C-O 121.568 0.699 . . . . 0.0 110.405 -179.596 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 53.5 mt -62.21 -38.12 87.94 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.721 179.504 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 18.0 m -59.41 -41.8 90.3 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.996 179.926 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.706 ' OE1' HD11 ' A' ' 52' ' ' LEU . 2.7 pt20 -57.99 -43.82 86.8 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.282 -0.567 . . . . 0.0 110.269 179.839 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.587 ' N ' ' HG2' ' A' ' 41' ' ' GLN . 15.0 mt -64.19 -38.17 90.1 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.323 -179.411 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 73.6 ttp85 -51.0 -39.22 55.18 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.477 -179.402 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 51.4 t-20 -56.25 -39.55 72.77 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.411 -179.313 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 153.06 175.02 24.05 Favored Glycine 0 CA--C 1.524 0.595 0 N-CA-C 111.016 -0.834 . . . . 0.0 111.016 179.73 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -70.25 142.04 44.76 Favored 'Trans proline' 0 C--N 1.308 -1.6 0 C-N-CA 122.694 2.263 . . . . 0.0 111.764 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.519 HD12 ' O ' ' A' ' 47' ' ' LEU . 0.3 OUTLIER -162.81 160.62 19.44 Favored Pre-proline 0 C--N 1.326 -0.441 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.684 -179.838 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -63.26 142.01 84.47 Favored 'Trans proline' 0 N--CA 1.495 1.565 0 C-N-CA 122.519 2.146 . . . . 0.0 112.341 179.086 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 46.6 t -62.28 -43.16 97.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.423 179.457 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 89.6 m -55.86 -69.28 0.15 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.825 -179.317 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 63.1 t0 -52.23 -40.67 61.93 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.226 0.536 . . . . 0.0 109.719 -179.33 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.727 HD13 ' C ' ' A' ' 52' ' ' LEU . 2.9 tm? -59.02 -48.22 82.38 Favored 'General case' 0 C--N 1.316 -0.875 0 C-N-CA 119.732 -0.787 . . . . 0.0 110.336 -179.451 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.578 ' O ' ' N ' ' A' ' 58' ' ' MET . . . -56.34 -39.23 72.49 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.358 0.599 . . . . 0.0 110.315 -179.333 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -65.04 -28.8 69.73 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.592 179.476 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ALA . . . . . 0.401 ' HB3' ' O ' ' A' ' 52' ' ' LEU . . . -63.28 -43.42 97.98 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.923 179.928 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.43 HG23 ' N ' ' A' ' 57' ' ' GLY . 8.5 tt -164.14 -36.06 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.921 -179.556 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' GLY . . . . . 0.43 ' N ' HG23 ' A' ' 56' ' ' ILE . . . -54.74 -71.47 0.71 Allowed Glycine 0 CA--C 1.522 0.515 0 N-CA-C 111.205 -0.758 . . . . 0.0 111.205 -178.197 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.578 ' N ' ' O ' ' A' ' 53' ' ' ALA . 0.1 OUTLIER 64.64 27.21 13.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.678 0.275 . . . . 0.0 110.345 179.749 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -153.76 59.07 0.74 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.908 0.385 . . . . 0.0 110.034 -179.323 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 11.0 mt-30 -44.3 -26.05 0.29 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.525 -179.629 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 49.5 m -70.39 -46.12 64.65 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.896 179.798 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.76 -32.25 73.85 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.327 179.867 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 57.7 t -70.38 -50.63 44.64 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.273 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.689 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 11.2 t -58.08 -43.27 86.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.341 -179.664 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -62.12 -50.87 70.18 Favored 'General case' 0 C--O 1.239 0.501 0 CA-C-O 121.048 0.451 . . . . 0.0 110.79 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 86.6 mt-30 -63.36 -35.42 80.34 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.312 179.72 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 6.7 tp -62.99 -44.67 95.41 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.301 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -61.77 -40.7 96.11 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.796 0.331 . . . . 0.0 110.293 179.878 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 89.3 t -65.73 -54.28 29.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 C-N-CA 120.159 -0.616 . . . . 0.0 110.594 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 91.1 mt -60.9 -39.21 88.44 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.879 0.371 . . . . 0.0 110.059 -179.591 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 77.3 ttt-85 -59.63 -40.91 89.17 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.399 179.744 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -56.89 -47.53 80.27 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.338 -179.253 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.519 HD22 ' N ' ' A' ' 73' ' ' LEU . 4.0 mm? -65.89 -41.28 91.74 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.685 179.321 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 110.19 33.54 2.53 Favored Glycine 0 CA--C 1.526 0.749 0 N-CA-C 110.978 -0.849 . . . . 0.0 110.978 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.504 HD22 ' N ' ' A' ' 75' ' ' LEU . 3.8 mm? -91.2 -18.37 24.54 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.781 0.324 . . . . 0.0 110.601 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 31.6 m -136.38 160.13 38.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.159 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 46.5 t -134.54 142.07 41.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.421 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -115.57 140.7 16.42 Favored Glycine 0 CA--C 1.525 0.66 0 N-CA-C 110.496 -1.042 . . . . 0.0 110.496 179.299 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 . . . . . 0 N--CA 1.466 0.335 0 CA-C-O 120.837 0.351 . . . . 0.0 110.385 -179.915 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 54.5 t . . . . . 0 N--CA 1.464 0.231 0 N-CA-C 110.222 -0.288 . . . . 0.0 110.222 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 65.4 m-85 -110.72 133.22 53.53 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.325 179.787 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 26.0 t -151.14 172.13 16.27 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.143 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 60.3 mt -69.61 147.67 50.38 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.629 -179.728 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 6.9 t80 -54.54 -47.66 72.91 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.36 -179.668 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 45.6 t0 -147.03 165.29 30.34 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.869 0.366 . . . . 0.0 110.601 -179.869 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' THR . . . . . 0.556 ' O ' ' HB3' ' A' ' 95' ' ' ALA . 80.8 p -75.1 -22.32 58.33 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.578 -179.931 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -40.22 -66.13 0.34 Allowed 'General case' 0 C--O 1.236 0.368 0 CA-C-O 121.101 0.477 . . . . 0.0 110.637 -179.922 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 22.7 m -50.48 -35.35 12.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.101 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.556 ' HB3' ' O ' ' A' ' 92' ' ' THR . . . -64.55 -41.06 96.56 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.542 179.607 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 96.5 mm-40 -61.27 -45.79 93.05 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.925 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 15.2 tp -60.09 -43.53 95.45 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.302 -0.559 . . . . 0.0 110.102 -179.632 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 52.3 tp -64.21 -38.06 89.7 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.077 -179.77 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.9 m-20 -60.99 -43.5 98.74 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.233 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -67.02 -43.83 81.81 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.352 179.334 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.07 -44.04 91.81 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.183 -0.462 . . . . 0.0 109.78 179.216 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 4.8 mm -63.85 -43.71 97.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 121.213 0.53 . . . . 0.0 110.588 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -60.73 -44.4 96.71 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.082 -179.886 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' HIS . . . . . 0.623 ' ND1' ' N ' ' A' ' 105' ' ' SER . 0.0 OUTLIER -67.72 -34.65 77.28 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.103 179.523 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.623 ' N ' ' ND1' ' A' ' 104' ' ' HIS . 5.6 t -59.15 -50.59 73.46 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.383 -178.141 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 13.2 tm-20 -75.35 -52.89 9.72 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.93 179.265 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 4.2 m-70 . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.123 -178.733 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 91.0 m-20 . . . . . 0 C--O 1.237 0.441 0 CA-C-O 121.281 0.563 . . . . 0.0 110.979 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 5.6 t -57.67 -44.65 85.9 Favored 'General case' 0 C--O 1.24 0.555 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.444 -179.326 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 67.1 mm-40 -66.44 -42.17 88.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.35 179.797 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 138' ' ' ALA . . . . . 0.546 ' O ' HG23 ' B' ' 142' ' ' VAL . . . -51.7 -47.51 63.9 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.457 -0.572 . . . . 0.0 109.457 -179.049 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -61.53 -53.45 56.17 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 120.329 -0.548 . . . . 0.0 110.196 178.774 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -52.66 -47.36 67.16 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 120.74 -0.384 . . . . 0.0 111.088 179.767 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 88.6 mm-40 -56.61 -49.46 74.89 Favored 'General case' 0 C--O 1.241 0.608 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.647 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 142' ' ' VAL . . . . . 0.546 HG23 ' O ' ' B' ' 138' ' ' ALA . 80.3 t -60.94 -38.31 79.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.891 179.617 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 143' ' ' ALA . . . . . 0.697 ' HB2' HD12 ' A' ' 36' ' ' LEU . . . -64.36 -42.02 96.43 Favored 'General case' 0 C--O 1.22 -0.481 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.485 178.819 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 75.3 m -56.3 -50.05 72.54 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.914 0.388 . . . . 0.0 110.956 -178.736 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 145' ' ' THR . . . . . 0.42 ' O ' HD13 ' B' ' 149' ' ' LEU . 1.4 t -65.81 -48.96 69.94 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.925 179.82 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 146' ' ' LEU . . . . . 0.438 HD23 ' HA ' ' B' ' 146' ' ' LEU . 68.9 mt -61.44 -26.4 67.85 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.858 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 147' ' ' GLN . . . . . 0.667 ' NE2' ' NE2' ' A' ' 28' ' ' GLN . 31.0 tp60 -73.25 -59.08 2.87 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.341 179.178 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -56.24 -54.0 50.47 Favored 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 120.761 -0.375 . . . . 0.0 110.728 -179.319 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.512 ' O ' ' O ' ' B' ' 150' ' ' ALA . 7.4 mp -46.47 -34.75 5.01 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.266 -179.105 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 150' ' ' ALA . . . . . 0.512 ' O ' ' O ' ' B' ' 149' ' ' LEU . . . -57.6 -130.81 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.548 0 O-C-N 123.641 0.588 . . . . 0.0 109.955 179.381 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 151' ' ' THR . . . . . 0.49 ' O ' ' O ' ' B' ' 150' ' ' ALA . 0.7 OUTLIER 52.85 111.81 0.01 OUTLIER Pre-proline 0 CA--C 1.542 0.66 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.393 179.72 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -49.69 -57.02 2.58 Favored 'Trans proline' 0 N--CA 1.496 1.624 0 C-N-CA 122.149 1.899 . . . . 0.0 113.425 -179.381 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 61.1 p -53.36 -46.34 69.54 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.165 -178.135 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 10.6 mpt_? -61.28 -42.41 98.6 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.51 -179.623 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 155' ' ' LEU . . . . . 0.682 HD12 ' HB2' ' A' ' 24' ' ' ALA . 4.9 mt -61.58 -51.8 67.05 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 120.375 -0.53 . . . . 0.0 110.749 -179.178 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 11.4 tpt -53.91 -48.83 69.76 Favored 'General case' 0 C--O 1.24 0.6 0 C-N-CA 120.263 -0.575 . . . . 0.0 110.351 -179.664 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 157' ' ' ILE . . . . . 0.419 ' O ' ' HG2' ' B' ' 160' ' ' GLN . 96.6 mt -63.38 -45.41 98.15 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 CA-C-O 121.67 0.748 . . . . 0.0 110.395 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 52.4 mt -62.33 -38.29 88.9 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.574 179.645 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 11.7 m -59.42 -42.7 92.44 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.977 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 160' ' ' GLN . . . . . 0.703 ' OE1' HD11 ' B' ' 171' ' ' LEU . 2.9 pt20 -57.14 -44.33 83.29 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 120.384 -0.526 . . . . 0.0 110.316 179.875 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 161' ' ' LEU . . . . . 0.596 ' N ' ' HG2' ' B' ' 160' ' ' GLN . 13.9 mt -64.55 -37.25 86.89 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.254 -179.335 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 162' ' ' ARG . . . . . . . . . . . . . 73.5 ttp85 -52.19 -38.2 57.11 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.323 -179.363 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 49.8 t-20 -56.32 -40.76 74.9 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.86 0.362 . . . . 0.0 110.212 -179.655 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . 153.18 178.07 27.37 Favored Glycine 0 CA--C 1.524 0.612 0 N-CA-C 111.17 -0.772 . . . . 0.0 111.17 179.09 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_exo -69.08 143.83 55.52 Favored 'Trans proline' 0 C--N 1.312 -1.382 0 C-N-CA 122.764 2.309 . . . . 0.0 112.103 -179.723 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 166' ' ' LEU . . . . . 0.568 ' O ' HD12 ' B' ' 166' ' ' LEU . 0.3 OUTLIER -165.69 159.48 13.42 Favored Pre-proline 0 C--N 1.326 -0.427 0 C-N-CA 120.336 -0.546 . . . . 0.0 110.714 179.682 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -63.81 142.53 83.04 Favored 'Trans proline' 0 N--CA 1.495 1.598 0 C-N-CA 122.413 2.075 . . . . 0.0 112.367 178.782 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . 48.0 t -62.69 -42.85 97.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.398 179.437 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 169' ' ' THR . . . . . 0.46 HG23 HE22 ' B' ' 179' ' ' GLN . 17.0 m -55.83 -69.18 0.15 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.817 -179.608 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 47.6 t0 -52.39 -40.42 62.05 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-O 121.362 0.601 . . . . 0.0 109.818 -179.18 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 171' ' ' LEU . . . . . 0.728 ' C ' HD13 ' B' ' 171' ' ' LEU . 2.9 tm? -59.59 -47.95 83.55 Favored 'General case' 0 N--CA 1.439 -0.975 0 C-N-CA 119.707 -0.797 . . . . 0.0 110.413 -179.589 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 172' ' ' ALA . . . . . 0.553 ' O ' ' N ' ' B' ' 177' ' ' MET . . . -56.36 -39.69 73.31 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.345 0.593 . . . . 0.0 110.252 -179.444 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -64.3 -28.45 69.72 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.575 179.312 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 174' ' ' ALA . . . . . 0.419 ' HB3' ' O ' ' B' ' 171' ' ' LEU . . . -63.64 -41.0 98.28 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.093 -179.921 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 6.0 tt -168.72 -33.5 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.895 -179.392 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . -54.78 -63.87 4.85 Favored Glycine 0 CA--C 1.523 0.552 0 C-N-CA 120.812 -0.709 . . . . 0.0 111.472 -178.156 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 177' ' ' MET . . . . . 0.553 ' N ' ' O ' ' B' ' 172' ' ' ALA . 3.4 mmt 56.07 29.22 14.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.716 0.293 . . . . 0.0 110.269 -179.917 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 86.4 mt-10 -155.35 60.87 0.63 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.36 -179.575 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 179' ' ' GLN . . . . . 0.46 HE22 HG23 ' B' ' 169' ' ' THR . 18.0 mt-30 -47.1 -28.19 1.66 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.504 -179.583 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 48.0 m -69.92 -45.4 67.62 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.769 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -65.02 -32.21 73.83 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.437 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 63.5 t -70.22 -50.5 46.44 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.266 0 C-N-CA 120.873 -0.331 . . . . 0.0 110.755 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 13.5 t -58.7 -41.81 87.13 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.217 -179.856 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -62.6 -50.97 69.16 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-O 121.089 0.471 . . . . 0.0 110.779 -179.963 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -64.12 -34.12 77.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.145 179.831 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 7.2 tp -63.47 -45.15 92.12 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.172 179.906 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -61.81 -41.74 98.14 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.752 0.31 . . . . 0.0 110.262 -179.951 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 83.9 t -64.07 -54.67 28.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 C-N-CA 120.107 -0.637 . . . . 0.0 110.474 -179.834 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 93.0 mt -61.07 -39.07 88.5 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 -179.445 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 73.0 ttt-85 -58.72 -40.43 83.73 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.482 179.746 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 17.6 m120 -58.17 -46.43 85.74 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.674 -0.41 . . . . 0.0 110.442 -179.468 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 192' ' ' LEU . . . . . 0.519 ' N ' HD22 ' B' ' 192' ' ' LEU . 3.9 mm? -66.49 -41.01 89.59 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.631 179.4 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 108.74 34.57 2.59 Favored Glycine 0 CA--C 1.524 0.608 0 N-CA-C 111.015 -0.834 . . . . 0.0 111.015 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 194' ' ' LEU . . . . . 0.505 HD22 ' N ' ' B' ' 194' ' ' LEU . 3.9 mm? -92.31 -17.6 24.5 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.82 0.343 . . . . 0.0 110.519 179.942 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 27.5 m -137.29 160.49 35.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.232 179.864 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 196' ' ' VAL . . . . . . . . . . . . . 50.4 t -135.49 143.59 36.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.284 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 197' ' ' GLY . . . . . . . . . . . . . . . -117.09 141.15 16.45 Favored Glycine 0 CA--C 1.523 0.575 0 N-CA-C 110.643 -0.983 . . . . 0.0 110.643 179.605 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 . . . . . 0 N--CA 1.467 0.389 0 CA-C-O 120.864 0.364 . . . . 0.0 110.466 179.943 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 58.5 t . . . . . 0 N--CA 1.464 0.25 0 N-CA-C 110.189 -0.3 . . . . 0.0 110.189 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 -111.85 133.84 53.8 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.429 179.691 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 45.5 t -151.78 172.33 16.31 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.211 179.902 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . 56.8 mt -69.11 147.72 51.02 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.56 -179.729 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 7.2 t80 -54.56 -46.29 73.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.257 -179.768 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 45.2 t0 -147.91 170.58 17.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.557 -179.665 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 211' ' ' THR . . . . . 0.492 ' O ' ' HB3' ' B' ' 214' ' ' ALA . 81.6 p -80.14 -19.36 47.41 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.63 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 212' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -43.38 -65.84 0.45 Allowed 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.159 0.504 . . . . 0.0 110.738 -179.851 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 213' ' ' VAL . . . . . 0.427 HG23 ' N ' ' B' ' 214' ' ' ALA . 29.4 m -50.41 -36.8 13.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.214 -179.667 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 214' ' ' ALA . . . . . 0.492 ' HB3' ' O ' ' B' ' 211' ' ' THR . . . -63.16 -40.28 97.1 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.501 179.673 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 97.4 mm-40 -62.36 -45.89 91.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.987 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 216' ' ' LEU . . . . . . . . . . . . . 15.3 tp -59.62 -43.55 93.76 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.227 -0.589 . . . . 0.0 110.02 -179.551 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 56.1 tp -63.89 -39.58 94.5 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.046 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 99.9 m-20 -59.41 -44.04 92.9 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.352 -179.599 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 219' ' ' GLU . . . . . . . . . . . . . 67.7 mm-40 -66.26 -44.02 84.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.457 179.105 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -59.32 -44.17 92.61 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 179.284 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 4.7 mm -63.36 -44.01 98.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 121.158 0.504 . . . . 0.0 110.457 -179.886 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 222' ' ' TYR . . . . . 0.441 ' O ' ' CG ' ' B' ' 226' ' ' HIS . 3.8 m-85 -61.2 -42.83 99.29 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.111 -179.801 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 223' ' ' HIS . . . . . 0.629 ' ND1' ' N ' ' B' ' 224' ' ' SER . 0.0 OUTLIER -68.76 -36.37 78.25 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.061 0.458 . . . . 0.0 110.228 179.431 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 224' ' ' SER . . . . . 0.629 ' N ' ' ND1' ' B' ' 223' ' ' HIS . 41.6 t -58.84 -49.09 79.04 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.122 -178.097 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 9.6 tm-20 -75.58 -54.42 7.02 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.955 179.135 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 226' ' ' HIS . . . . . 0.441 ' CG ' ' O ' ' B' ' 222' ' ' TYR . 4.7 m-70 . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.21 -178.695 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ASP . . . . . 0.506 ' O ' ' N ' ' A' ' 19' ' ' ALA . 19.1 t70 . . . . . 0 N--CA 1.462 0.148 0 CA-C-O 120.593 0.235 . . . . 0.0 110.82 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 42.2 t -38.72 -42.33 0.79 Allowed 'General case' 0 C--O 1.241 0.657 0 CA-C-O 121.375 0.607 . . . . 0.0 110.381 -179.961 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 54.6 mt-30 -65.32 -43.3 91.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.164 179.022 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.506 ' N ' ' O ' ' A' ' 16' ' ' ASP . . . -62.61 -31.44 72.28 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.108 179.639 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.88 -53.27 53.21 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 179.683 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.37 -46.14 83.69 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.489 -0.484 . . . . 0.0 110.81 179.365 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 59.3 tt0 -56.1 -51.11 69.07 Favored 'General case' 0 C--O 1.242 0.668 0 CA-C-O 121.544 0.687 . . . . 0.0 110.38 -179.778 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 75.2 t -62.41 -43.31 98.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.753 179.558 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.461 ' HB2' HD12 ' B' ' 155' ' ' LEU . . . -49.39 -50.22 41.22 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.299 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 58.1 m -59.18 -42.34 90.59 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 91.2 m -63.31 -50.92 68.13 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 120.363 -0.535 . . . . 0.0 111.105 179.869 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 96.0 mt -68.35 -22.16 64.69 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.56 -179.739 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.502 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 49.5 tt0 -74.69 -58.0 3.57 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.281 179.559 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.6 -54.14 50.38 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.722 -0.391 . . . . 0.0 110.283 -179.731 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.496 ' O ' ' O ' ' A' ' 31' ' ' ALA . 77.1 mt -44.91 -33.14 1.86 Allowed 'General case' 0 CA--C 1.513 -0.481 0 C-N-CA 121.024 -0.27 . . . . 0.0 110.458 -179.198 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.502 ' HB3' ' O ' ' A' ' 28' ' ' GLN . . . -57.61 -128.27 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.12 179.233 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.47 ' HG1' ' HB3' ' A' ' 35' ' ' ARG . 0.6 OUTLIER 54.26 107.18 0.03 OUTLIER Pre-proline 0 CA--C 1.54 0.579 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.571 -179.959 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -49.27 -58.68 1.6 Allowed 'Trans proline' 0 N--CA 1.496 1.663 0 C-N-CA 122.165 1.91 . . . . 0.0 113.429 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 78.4 p -55.54 -43.33 75.69 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.802 -179.149 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.47 ' HB3' ' HG1' ' A' ' 32' ' ' THR . 44.4 ttm180 -61.06 -44.29 97.61 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 120.817 -0.353 . . . . 0.0 110.663 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.468 HD12 ' HB2' ' B' ' 143' ' ' ALA . 7.1 mt -61.03 -45.74 93.57 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.467 -0.493 . . . . 0.0 110.908 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.614 ' SD ' HD11 ' A' ' 56' ' ' ILE . 0.0 OUTLIER -55.21 -46.79 75.91 Favored 'General case' 0 C--N 1.319 -0.741 0 C-N-CA 120.15 -0.62 . . . . 0.0 110.163 -179.886 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.484 ' CD1' ' OE1' ' A' ' 66' ' ' GLN . 65.0 mt -63.72 -45.34 97.59 Favored 'Isoleucine or valine' 0 C--O 1.239 0.532 0 CA-C-O 121.601 0.715 . . . . 0.0 110.734 -179.824 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -63.28 -40.95 98.83 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.765 179.827 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.437 ' OG1' ' O ' ' A' ' 37' ' ' MET . 15.3 p -61.42 -37.34 83.15 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.944 179.974 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 19.8 mm-40 -62.1 -47.46 84.53 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.516 -0.474 . . . . 0.0 109.855 179.335 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 29.3 mt -64.54 -35.39 80.8 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.762 179.525 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 62.5 ttp180 -55.15 -31.94 61.73 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.57 -179.521 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 98.4 m-20 -61.15 -41.03 96.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.507 -179.647 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.42 ' O ' ' CD2' ' A' ' 47' ' ' LEU . . . 155.83 -160.38 29.96 Favored Glycine 0 CA--C 1.528 0.847 0 N-CA-C 110.951 -0.86 . . . . 0.0 110.951 180.0 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_exo -61.67 144.08 97.07 Favored 'Trans proline' 0 C--N 1.309 -1.528 0 C-N-CA 122.96 2.44 . . . . 0.0 111.976 179.499 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.43 HD12 ' O ' ' A' ' 47' ' ' LEU . 0.3 OUTLIER 176.95 94.21 0.12 Allowed Pre-proline 0 CA--C 1.538 0.507 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.353 179.706 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo -48.32 177.88 0.01 OUTLIER 'Trans proline' 0 C--N 1.297 -2.155 0 C-N-CA 122.282 1.988 . . . . 0.0 112.485 -179.737 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.521 HG23 ' N ' ' A' ' 50' ' ' THR . 4.7 m -59.97 -42.39 89.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 121.51 0.671 . . . . 0.0 110.367 -179.759 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.521 ' N ' HG23 ' A' ' 49' ' ' VAL . 11.1 m -59.87 -41.4 91.43 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.007 -0.997 . . . . 0.0 110.537 179.641 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -73.95 -46.58 43.21 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.702 179.57 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.682 HD23 ' O ' ' A' ' 52' ' ' LEU . 5.2 tt -61.42 -45.52 93.97 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.586 -179.281 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.86 -46.33 78.85 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.666 -0.414 . . . . 0.0 111.281 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -55.61 -35.81 66.27 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.138 -179.429 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ALA . . . . . 0.484 ' O ' HG23 ' A' ' 56' ' ' ILE . . . -50.96 -59.59 3.98 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.516 -0.473 . . . . 0.0 110.708 -179.291 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.614 HD11 ' SD ' ' A' ' 37' ' ' MET . 2.2 pp -158.84 -18.17 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.605 -179.704 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -58.84 -64.78 3.98 Favored Glycine 0 CA--C 1.523 0.552 0 N-CA-C 111.209 -0.756 . . . . 0.0 111.209 -179.171 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.488 ' O ' ' SD ' ' A' ' 58' ' ' MET . 0.0 OUTLIER 67.73 40.45 2.45 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.713 0.292 . . . . 0.0 110.328 179.996 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.477 ' O ' ' N ' ' A' ' 61' ' ' SER . 72.1 tt0 -169.01 60.86 0.05 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 13.1 mt-30 -41.45 -23.12 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.766 -179.434 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.477 ' N ' ' O ' ' A' ' 59' ' ' GLU . 69.3 m -68.7 -43.34 76.24 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.917 179.923 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.461 ' H ' ' HG2' ' A' ' 59' ' ' GLU . . . -68.12 -30.5 69.66 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.628 -179.888 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 59.4 t -72.18 -51.59 29.27 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.294 0 C-N-CA 120.882 -0.327 . . . . 0.0 110.845 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 40.8 t -59.8 -42.28 93.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.33 -179.738 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -62.82 -51.21 67.92 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-O 120.986 0.422 . . . . 0.0 110.995 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' GLN . . . . . 0.484 ' OE1' ' CD1' ' A' ' 38' ' ' ILE . 73.5 mt-30 -63.66 -36.87 85.27 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.055 0.455 . . . . 0.0 110.471 179.968 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 5.9 tt -62.1 -43.75 98.15 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.479 -179.76 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -62.97 -41.79 99.64 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.862 0.363 . . . . 0.0 110.434 179.459 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 75.5 t -61.52 -54.18 38.42 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.206 0 C-N-CA 119.88 -0.728 . . . . 0.0 110.134 -179.726 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 94.9 mt -62.31 -37.31 85.09 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.175 0.512 . . . . 0.0 109.851 -179.561 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 7.4 tmm_? -57.34 -38.82 74.71 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.454 -179.842 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 99.0 m-20 -62.07 -41.09 97.81 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.421 -179.823 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.447 HD23 ' N ' ' A' ' 73' ' ' LEU . 7.2 mt -66.02 -39.11 89.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.242 -179.488 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 102.79 31.72 5.03 Favored Glycine 0 CA--C 1.525 0.678 0 N-CA-C 111.011 -0.836 . . . . 0.0 111.011 -179.839 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 83.9 mt -95.04 -15.7 23.26 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 120.751 0.31 . . . . 0.0 110.701 179.774 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 33.4 m -136.88 160.7 36.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.088 179.855 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 40.3 t -137.71 150.42 25.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.345 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -124.74 145.89 15.94 Favored Glycine 0 CA--C 1.52 0.397 0 N-CA-C 110.237 -1.145 . . . . 0.0 110.237 179.437 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 . . . . . 0 C--O 1.236 0.363 0 CA-C-O 120.827 0.346 . . . . 0.0 110.469 -179.996 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 78.8 t . . . . . 0 C--O 1.231 0.124 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 -104.86 129.94 53.09 Favored 'General case' 0 CA--C 1.52 -0.181 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 50.7 m -149.24 171.38 16.58 Favored 'General case' 0 N--CA 1.462 0.151 0 N-CA-C 110.049 -0.352 . . . . 0.0 110.049 -179.685 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 17.7 mt -67.98 148.96 50.33 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.428 -179.304 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -52.01 -44.92 64.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.2 -179.582 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.451 ' CG ' ' H ' ' A' ' 92' ' ' THR . 13.2 t70 -147.44 -177.55 5.76 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.327 -179.97 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 92' ' ' THR . . . . . 0.451 ' H ' ' CG ' ' A' ' 91' ' ' ASP . 6.6 p -90.86 -13.46 33.65 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.576 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 40.1 m80 -48.74 -65.08 0.63 Allowed 'General case' 0 C--O 1.235 0.323 0 CA-C-O 120.809 0.337 . . . . 0.0 110.712 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.46 HG23 ' N ' ' A' ' 95' ' ' ALA . 27.2 m -50.74 -38.79 17.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.062 -179.684 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.46 ' N ' HG23 ' A' ' 94' ' ' VAL . . . -61.66 -41.07 97.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.338 179.778 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 64.6 tp60 -61.92 -45.72 92.46 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.866 -179.615 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 13.0 tp -59.4 -42.32 91.47 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.584 -0.446 . . . . 0.0 110.133 -179.257 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 92.7 mt -63.33 -40.23 96.73 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.149 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' ASP . . . . . 0.435 ' OD1' ' CE1' ' A' ' 103' ' ' TYR . 65.7 t0 -60.22 -42.58 95.49 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.201 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -67.09 -50.22 62.33 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.491 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -56.19 -43.28 78.3 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 179.621 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 4.6 mm -62.48 -43.69 98.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 C-N-CA 120.384 -0.526 . . . . 0.0 110.439 -179.735 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' TYR . . . . . 0.435 ' CE1' ' OD1' ' A' ' 99' ' ' ASP . 3.3 m-85 -58.87 -41.31 86.77 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.868 -179.942 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 68.7 t60 -65.8 -38.78 89.89 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.619 179.501 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 43.2 t -58.96 -46.32 88.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.24 -179.638 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -75.01 -58.05 3.52 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.008 0.432 . . . . 0.0 110.954 179.228 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 84.7 t60 . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 115.725 -0.671 . . . . 0.0 109.735 -179.341 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 135' ' ' ASP . . . . . 0.498 ' O ' ' N ' ' B' ' 138' ' ' ALA . 20.3 t70 . . . . . 0 N--CA 1.46 0.07 0 CA-C-O 120.698 0.285 . . . . 0.0 110.758 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 25.8 t -38.47 -42.05 0.71 Allowed 'General case' 0 C--O 1.242 0.659 0 CA-C-O 121.218 0.533 . . . . 0.0 110.484 -179.722 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 74.9 mt-30 -65.45 -43.59 89.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.041 179.146 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 138' ' ' ALA . . . . . 0.498 ' N ' ' O ' ' B' ' 135' ' ' ASP . . . -62.97 -31.34 72.43 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.211 179.729 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -64.12 -53.11 54.75 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 120.957 0.408 . . . . 0.0 109.901 179.677 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -57.63 -46.78 83.7 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.737 179.424 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -55.9 -50.02 71.83 Favored 'General case' 0 C--O 1.242 0.67 0 CA-C-O 121.563 0.697 . . . . 0.0 110.171 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 142' ' ' VAL . . . . . 0.407 HG23 ' O ' ' B' ' 138' ' ' ALA . 77.7 t -62.61 -43.56 98.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.688 179.611 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 143' ' ' ALA . . . . . 0.468 ' HB2' HD12 ' A' ' 36' ' ' LEU . . . -49.63 -49.27 47.73 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.418 179.888 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 55.2 m -59.17 -43.0 92.12 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.33 -0.395 . . . . 0.0 109.977 179.867 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 89.0 m -63.27 -50.39 70.33 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 120.386 -0.526 . . . . 0.0 110.995 179.906 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 96.0 mt -68.82 -22.78 64.22 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.799 -179.785 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 147' ' ' GLN . . . . . 0.485 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 49.9 tt0 -74.62 -57.63 3.8 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.402 179.483 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -58.63 -54.13 50.52 Favored 'General case' 0 CA--C 1.519 -0.227 0 C-N-CA 120.57 -0.452 . . . . 0.0 110.388 -179.579 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.501 ' O ' ' O ' ' B' ' 150' ' ' ALA . 77.5 mt -45.26 -33.53 2.42 Favored 'General case' 0 CA--C 1.513 -0.465 0 C-N-CA 121.021 -0.272 . . . . 0.0 110.441 -178.969 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 150' ' ' ALA . . . . . 0.501 ' O ' ' O ' ' B' ' 149' ' ' LEU . . . -57.1 -128.35 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.238 0.542 . . . . 0.0 110.309 179.363 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 151' ' ' THR . . . . . 0.495 ' HG1' ' C ' ' B' ' 150' ' ' ALA . 0.6 OUTLIER 54.3 108.61 0.02 OUTLIER Pre-proline 0 CA--C 1.541 0.623 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.558 -179.722 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -49.73 -59.18 1.32 Allowed 'Trans proline' 0 N--CA 1.494 1.555 0 C-N-CA 122.197 1.931 . . . . 0.0 113.317 179.73 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 84.3 p -54.92 -43.96 73.78 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.812 -179.101 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 44.2 ttm180 -60.79 -44.43 96.84 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.574 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 155' ' ' LEU . . . . . 0.461 HD12 ' HB2' ' A' ' 24' ' ' ALA . 7.2 mt -60.92 -46.16 91.78 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.365 -0.534 . . . . 0.0 110.694 -179.926 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 156' ' ' MET . . . . . 0.634 ' SD ' HD11 ' B' ' 175' ' ' ILE . 0.0 OUTLIER -54.58 -47.22 73.56 Favored 'General case' 0 C--N 1.318 -0.764 0 C-N-CA 120.116 -0.634 . . . . 0.0 110.131 -179.91 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 157' ' ' ILE . . . . . 0.452 ' CD1' ' OE1' ' B' ' 185' ' ' GLN . 67.4 mt -63.61 -45.78 96.64 Favored 'Isoleucine or valine' 0 C--O 1.239 0.544 0 CA-C-O 121.483 0.658 . . . . 0.0 110.808 -179.757 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -63.01 -40.45 97.81 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.866 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 159' ' ' THR . . . . . 0.443 HG23 ' O ' ' B' ' 155' ' ' LEU . 18.1 p -61.22 -38.17 85.66 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 116.088 -0.505 . . . . 0.0 109.938 -180.0 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 12.9 mm-40 -61.52 -47.29 86.27 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.549 -0.46 . . . . 0.0 109.923 179.395 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 161' ' ' LEU . . . . . . . . . . . . . 29.4 mt -64.71 -34.79 79.15 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.837 179.622 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 162' ' ' ARG . . . . . . . . . . . . . 62.6 ttp180 -56.3 -30.79 62.97 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.674 -179.46 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 98.1 m-20 -61.74 -41.1 97.21 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.462 -179.631 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 164' ' ' GLY . . . . . 0.427 ' O ' ' CD2' ' B' ' 166' ' ' LEU . . . 156.49 -160.44 30.22 Favored Glycine 0 CA--C 1.526 0.755 0 N-CA-C 110.887 -0.885 . . . . 0.0 110.887 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_exo -62.13 143.25 94.37 Favored 'Trans proline' 0 C--N 1.308 -1.556 0 C-N-CA 123.016 2.477 . . . . 0.0 112.024 179.434 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 166' ' ' LEU . . . . . 0.427 ' CD2' ' O ' ' B' ' 164' ' ' GLY . 0.3 OUTLIER 177.96 95.13 0.14 Allowed Pre-proline 0 CA--C 1.538 0.499 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.408 179.682 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_exo -48.51 177.94 0.02 OUTLIER 'Trans proline' 0 C--N 1.299 -2.075 0 C-N-CA 122.353 2.035 . . . . 0.0 112.377 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 168' ' ' VAL . . . . . 0.514 HG23 ' N ' ' B' ' 169' ' ' THR . 4.2 m -59.87 -42.36 88.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 121.589 0.709 . . . . 0.0 110.388 -179.728 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 169' ' ' THR . . . . . 0.514 ' N ' HG23 ' B' ' 168' ' ' VAL . 9.8 m -59.48 -40.84 88.29 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.454 179.902 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -74.11 -46.33 43.41 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.759 179.517 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 171' ' ' LEU . . . . . 0.681 HD23 ' O ' ' B' ' 171' ' ' LEU . 4.8 tt -61.64 -44.2 97.43 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.348 -178.971 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 172' ' ' ALA . . . . . . . . . . . . . . . -67.35 -46.94 71.91 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.131 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 82.3 tt0 -54.93 -36.38 65.2 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.219 -179.479 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 174' ' ' ALA . . . . . 0.506 ' O ' HG23 ' B' ' 175' ' ' ILE . . . -51.15 -59.6 4.01 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.463 -0.495 . . . . 0.0 110.821 -179.19 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 175' ' ' ILE . . . . . 0.634 HD11 ' SD ' ' B' ' 156' ' ' MET . 2.2 pp -159.08 -17.4 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.567 -179.493 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . -60.12 -64.17 4.4 Favored Glycine 0 CA--C 1.524 0.595 0 N-CA-C 111.112 -0.795 . . . . 0.0 111.112 -179.347 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 177' ' ' MET . . . . . 0.495 ' O ' ' SD ' ' B' ' 177' ' ' MET . 0.0 OUTLIER 66.71 40.78 3.16 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.707 0.289 . . . . 0.0 110.268 179.927 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 178' ' ' GLU . . . . . 0.49 ' O ' ' N ' ' B' ' 180' ' ' SER . 71.9 tt0 -168.33 60.41 0.06 Allowed 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 179.919 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 13.2 mt-30 -41.27 -22.82 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.766 -179.378 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 180' ' ' SER . . . . . 0.49 ' N ' ' O ' ' B' ' 178' ' ' GLU . 49.1 m -68.84 -43.85 74.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.99 179.831 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 181' ' ' ALA . . . . . 0.485 ' H ' ' HG2' ' B' ' 178' ' ' GLU . . . -68.02 -30.16 69.34 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.591 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 57.9 t -72.03 -51.66 29.49 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 C-N-CA 120.811 -0.356 . . . . 0.0 110.893 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 6.5 t -59.54 -42.61 92.73 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.255 -179.763 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -62.85 -50.69 69.95 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 120.931 0.396 . . . . 0.0 110.979 -179.961 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 185' ' ' GLN . . . . . 0.452 ' OE1' ' CD1' ' B' ' 157' ' ' ILE . 74.2 mt-30 -63.62 -36.72 84.75 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.533 179.915 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 5.8 tt -62.79 -44.07 97.14 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.662 -179.818 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -62.51 -41.78 99.06 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.413 179.607 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 76.8 t -61.66 -54.26 37.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 C-N-CA 119.881 -0.728 . . . . 0.0 110.174 -179.765 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 86.6 mt -62.26 -37.49 85.65 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.233 0.54 . . . . 0.0 109.954 -179.517 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 7.3 tmm_? -56.93 -40.07 75.67 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.454 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -61.33 -41.28 96.77 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.881 0.372 . . . . 0.0 110.325 -179.512 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 192' ' ' LEU . . . . . 0.463 ' N ' HD23 ' B' ' 192' ' ' LEU . 7.3 mt -65.53 -38.89 90.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.398 -179.508 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 102.46 30.26 5.67 Favored Glycine 0 CA--C 1.524 0.633 0 N-CA-C 110.857 -0.897 . . . . 0.0 110.857 -179.844 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 94.6 mt -93.66 -16.37 24.37 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.85 0.357 . . . . 0.0 110.689 179.905 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 35.7 m -136.53 160.47 37.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.323 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 196' ' ' VAL . . . . . . . . . . . . . 42.8 t -138.42 152.38 25.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.159 179.783 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 197' ' ' GLY . . . . . . . . . . . . . . . -127.44 147.64 17.15 Favored Glycine 0 CA--C 1.523 0.565 0 N-CA-C 110.448 -1.061 . . . . 0.0 110.448 179.685 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 . . . . . 0 N--CA 1.466 0.333 0 CA-C-O 120.897 0.38 . . . . 0.0 110.524 179.937 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 70.8 t . . . . . 0 N--CA 1.461 0.103 0 N-CA-C 109.959 -0.385 . . . . 0.0 109.959 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 -104.71 129.45 52.91 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 45.3 m -148.82 171.01 16.96 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 110.019 -0.363 . . . . 0.0 110.019 -179.627 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . 18.6 mt -68.41 149.78 48.93 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.454 -179.356 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 9.2 t80 -52.25 -46.44 65.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.316 -179.457 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 210' ' ' ASP . . . . . 0.51 ' CG ' ' H ' ' B' ' 211' ' ' THR . 19.0 t70 -146.17 -178.71 6.28 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.791 0.329 . . . . 0.0 110.295 -179.936 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 211' ' ' THR . . . . . 0.51 ' H ' ' CG ' ' B' ' 210' ' ' ASP . 30.7 p -88.5 -16.47 32.6 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.535 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 212' ' ' HIS . . . . . . . . . . . . . 37.8 m80 -46.47 -65.44 0.55 Allowed 'General case' 0 C--O 1.235 0.312 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.868 -179.834 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 213' ' ' VAL . . . . . 0.446 HG23 ' N ' ' B' ' 214' ' ' ALA . 20.3 m -50.38 -38.42 15.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 121.016 0.436 . . . . 0.0 110.139 -179.561 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 214' ' ' ALA . . . . . 0.446 ' N ' HG23 ' B' ' 213' ' ' VAL . . . -62.21 -40.93 97.74 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.215 179.754 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 68.0 tp60 -62.19 -46.05 90.66 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.871 -179.541 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 216' ' ' LEU . . . . . . . . . . . . . 14.5 tp -59.0 -42.97 91.37 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.003 -179.138 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 88.5 mt -62.8 -40.59 97.83 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.206 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 67.1 t0 -59.37 -43.79 92.83 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.333 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 219' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -66.43 -49.8 65.54 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.438 -0.347 . . . . 0.0 110.547 179.541 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -56.3 -43.02 78.5 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.855 -0.424 . . . . 0.0 109.855 179.496 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 4.2 mm -62.68 -43.55 98.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 C-N-CA 120.39 -0.524 . . . . 0.0 110.463 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -59.09 -41.3 87.72 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.797 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 223' ' ' HIS . . . . . . . . . . . . . 58.8 t60 -65.84 -37.93 87.53 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.471 179.504 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 6.7 t -58.92 -46.99 86.62 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.389 -179.747 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -75.39 -56.69 4.46 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 121.005 0.431 . . . . 0.0 110.898 179.309 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 85.7 t60 . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.864 -179.441 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 . . . . . 0 C--O 1.235 0.332 0 CA-C-O 121.097 0.475 . . . . 0.0 110.555 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 98.5 p -58.25 -33.48 69.41 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.459 -179.713 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 48.6 tt0 -67.19 -49.41 64.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.501 179.428 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.486 ' O ' HG23 ' A' ' 23' ' ' VAL . . . -56.81 -36.79 70.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.165 -179.78 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.426 ' HB1' ' HB3' ' B' ' 155' ' ' LEU . . . -66.31 -53.31 37.96 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.407 179.565 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.06 -44.95 94.35 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.952 -179.716 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -58.9 -50.65 73.24 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.255 0.55 . . . . 0.0 110.339 -179.806 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.486 HG23 ' O ' ' A' ' 19' ' ' ALA . 70.9 t -62.1 -44.4 98.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.94 179.562 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.27 -43.13 82.8 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.137 179.836 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 66.2 m -57.56 -43.51 84.56 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 179.793 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 21.4 m -64.22 -49.06 73.46 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.631 -0.428 . . . . 0.0 110.685 179.207 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 85.9 mt -63.42 -22.53 66.94 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.442 -179.845 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.526 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 57.6 tt0 -75.33 -57.98 3.56 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.654 179.42 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.21 -54.54 44.55 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.932 -179.391 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.549 ' O ' ' O ' ' A' ' 31' ' ' ALA . 3.9 mm? -48.74 -30.4 5.56 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 -178.962 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.549 ' O ' ' O ' ' A' ' 30' ' ' LEU . . . -56.54 -133.95 0.0 OUTLIER 'General case' 0 C--O 1.22 -0.498 0 C-N-CA 120.366 -0.534 . . . . 0.0 110.362 179.102 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.486 ' O ' ' O ' ' A' ' 31' ' ' ALA . 17.7 p 53.85 114.76 0.01 OUTLIER Pre-proline 0 CA--C 1.543 0.679 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.867 -179.807 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_exo -48.76 -44.54 31.1 Favored 'Trans proline' 0 N--CA 1.498 1.754 0 C-N-CA 122.229 1.953 . . . . 0.0 113.026 -179.74 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 39.5 t -59.92 -45.46 92.49 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.959 -178.926 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.406 ' HB3' ' HG1' ' A' ' 32' ' ' THR . 15.7 tpp180 -63.4 -36.47 83.82 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.388 -179.954 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.451 ' CD2' ' O ' ' A' ' 30' ' ' LEU . 1.6 mm? -63.15 -54.38 38.66 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.414 -0.514 . . . . 0.0 110.763 -179.181 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.413 ' O ' ' SD ' ' A' ' 37' ' ' MET . 0.0 OUTLIER -57.18 -49.23 76.61 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.008 -0.677 . . . . 0.0 110.639 -179.396 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 36.6 mm -62.62 -42.75 97.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-O 121.193 0.521 . . . . 0.0 110.383 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 42.6 tp -62.38 -43.03 99.77 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.785 -179.911 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.405 ' OG1' ' O ' ' A' ' 37' ' ' MET . 19.7 p -60.71 -35.88 77.43 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.305 -0.407 . . . . 0.0 109.997 -179.446 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -63.46 -45.85 88.91 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.274 -0.571 . . . . 0.0 110.108 178.932 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 98.1 mt -64.94 -42.54 94.55 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.951 179.701 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.532 ' NH1' ' OD1' ' A' ' 99' ' ' ASP . 68.7 ttp85 -52.04 -17.76 1.16 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.428 -179.9 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -75.91 -76.91 0.14 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.908 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -174.45 -143.67 4.51 Favored Glycine 0 CA--C 1.532 1.131 0 C-N-CA 120.539 -0.839 . . . . 0.0 111.217 -179.509 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -50.16 133.08 34.99 Favored 'Trans proline' 0 N--CA 1.493 1.464 0 C-N-CA 122.328 2.019 . . . . 0.0 112.184 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -136.68 66.79 57.53 Favored Pre-proline 0 CA--C 1.536 0.43 0 CA-C-O 121.547 0.689 . . . . 0.0 111.207 -179.941 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -51.61 148.51 20.85 Favored 'Trans proline' 0 C--N 1.299 -2.028 0 C-N-CA 121.852 1.701 . . . . 0.0 111.343 178.185 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 44.4 t -53.32 -51.4 41.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 121.253 0.549 . . . . 0.0 110.574 -178.377 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 48.4 p -62.92 -38.53 91.33 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.529 179.336 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -63.71 -41.39 98.11 Favored 'General case' 0 CA--C 1.514 -0.404 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.933 179.287 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.703 HD13 ' C ' ' A' ' 52' ' ' LEU . 2.8 tm? -61.58 -47.69 84.33 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 119.675 -0.81 . . . . 0.0 110.11 -179.492 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.515 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -52.69 -47.23 67.38 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.006 179.632 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 45.1 tp10 -54.85 -48.09 73.33 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.516 -0.474 . . . . 0.0 110.35 179.751 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -57.31 -54.0 51.71 Favored 'General case' 0 C--O 1.232 0.138 0 C-N-CA 120.493 -0.483 . . . . 0.0 111.012 -179.589 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.413 HD12 HD11 ' A' ' 52' ' ' LEU . 96.6 mt -89.08 -75.02 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.241 179.71 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' GLY . . . . . 0.515 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 133.02 96.97 0.63 Allowed Glycine 0 CA--C 1.522 0.513 0 N-CA-C 111.391 -0.684 . . . . 0.0 111.391 179.858 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.404 ' HA ' HE21 ' A' ' 60' ' ' GLN . 78.3 mtm 58.32 77.58 0.29 Allowed 'General case' 0 C--O 1.232 0.155 0 C-N-CA 120.974 -0.29 . . . . 0.0 110.878 179.117 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -173.33 32.63 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.25 0.548 . . . . 0.0 110.083 179.733 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.666 ' H ' ' CD ' ' A' ' 60' ' ' GLN . 0.0 OUTLIER -82.72 -25.06 33.27 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.612 -179.162 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.512 ' O ' ' ND1' ' A' ' 65' ' ' HIS . 73.1 m -65.82 -42.94 90.0 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.395 -179.917 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.56 -36.8 76.67 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.506 179.754 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.41 ' O ' HD23 ' A' ' 67' ' ' LEU . 55.1 t -69.78 -52.24 33.39 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.3 0 C-N-CA 120.495 -0.482 . . . . 0.0 110.802 179.759 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 11.7 t -60.44 -44.58 95.67 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.234 -0.587 . . . . 0.0 110.51 179.691 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' HIS . . . . . 0.579 ' CG ' HH21 ' A' ' 68' ' ' ARG . 0.9 OUTLIER -57.03 -47.54 80.67 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.41 -179.844 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 81.6 mt-30 -59.51 -41.53 90.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.86 0.362 . . . . 0.0 110.836 179.723 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.529 HD13 HG21 ' A' ' 76' ' ' VAL . 3.3 mm? -61.31 -44.14 97.71 Favored 'General case' 0 CA--C 1.513 -0.457 0 C-N-CA 120.616 -0.434 . . . . 0.0 110.56 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.579 HH21 ' CG ' ' A' ' 65' ' ' HIS . 88.2 mtm180 -61.61 -40.82 96.2 Favored 'General case' 0 C--N 1.312 -1.035 0 C-N-CA 120.402 -0.519 . . . . 0.0 110.62 179.777 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.529 HG23 ' O ' ' A' ' 65' ' ' HIS . 94.8 t -58.83 -52.31 61.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 -179.463 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 9.9 mp -67.06 -31.46 71.99 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.854 0.359 . . . . 0.0 110.282 179.042 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.669 HH12 ' N ' ' A' ' 78' ' ' GLY . 9.2 tpt180 -54.65 -43.83 72.69 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.881 -179.169 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -60.8 -43.59 97.96 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.329 -0.548 . . . . 0.0 110.38 179.87 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 10.0 mt -64.91 -38.92 92.59 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.024 0.44 . . . . 0.0 110.537 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 99.29 35.91 4.57 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 110.96 -0.856 . . . . 0.0 110.96 -179.722 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 85.0 mt -99.29 -19.03 17.28 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.746 0.307 . . . . 0.0 110.889 179.818 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.529 HG21 HD13 ' A' ' 67' ' ' LEU . 15.8 m -134.55 157.8 41.45 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.247 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.173 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.455 HG12 ' N ' ' A' ' 78' ' ' GLY . 70.8 t -136.8 156.83 35.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.302 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 78' ' ' GLY . . . . . 0.669 ' N ' HH12 ' A' ' 71' ' ' ARG . . . -133.29 132.74 6.64 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.856 -0.898 . . . . 0.0 110.856 179.344 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 8.8 t70 . . . . . 0 N--CA 1.465 0.278 0 CA-C-O 120.891 0.377 . . . . 0.0 110.467 179.857 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 97.9 t . . . . . 0 CA--C 1.523 -0.086 0 CA-C-O 120.722 0.296 . . . . 0.0 110.414 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 87.0 m-85 -95.52 127.58 41.67 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.38 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 34.5 p -150.15 165.72 32.0 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 116.195 -0.457 . . . . 0.0 109.867 -179.038 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.752 ' N ' HD22 ' A' ' 89' ' ' LEU . 2.5 mm? -67.82 146.52 53.61 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.561 -179.093 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.473 ' C ' ' CD1' ' A' ' 90' ' ' TYR . 16.4 t80 -58.27 -50.03 75.03 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.446 -179.515 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.527 ' OD1' ' N ' ' A' ' 92' ' ' THR . 53.7 t0 -101.0 155.6 17.88 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.473 -179.644 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 92' ' ' THR . . . . . 0.527 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 62.8 p -92.99 -24.34 18.39 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 121.104 0.478 . . . . 0.0 110.576 179.503 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -57.47 -47.94 80.52 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.221 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.554 HG13 ' N ' ' A' ' 95' ' ' ALA . 8.0 p -55.05 -44.78 75.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.243 -0.435 . . . . 0.0 109.857 -179.936 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.554 ' N ' HG13 ' A' ' 94' ' ' VAL . . . -56.0 -41.94 75.64 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.039 179.638 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 9.4 tp-100 -61.74 -39.49 91.76 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.071 179.616 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.514 ' CD1' ' HB2' ' B' ' 220' ' ' ALA . 13.5 tp -60.36 -43.51 96.44 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.153 -0.476 . . . . 0.0 109.92 -179.597 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.418 ' O ' HG22 ' A' ' 102' ' ' ILE . 4.1 mm? -64.25 -37.18 86.57 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.302 179.251 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 99' ' ' ASP . . . . . 0.532 ' OD1' ' NH1' ' A' ' 43' ' ' ARG . 97.2 m-20 -60.65 -39.89 90.0 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.186 0.517 . . . . 0.0 110.378 179.861 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -72.78 -47.24 48.33 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.391 -0.524 . . . . 0.0 110.653 179.4 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' ALA . . . . . 0.428 ' HB2' ' CD1' ' B' ' 216' ' ' LEU . . . -62.66 -50.94 69.21 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.042 -179.851 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.554 HG23 ' N ' ' A' ' 103' ' ' TYR . 10.7 tp -59.21 -47.13 91.34 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.412 -178.673 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 103' ' ' TYR . . . . . 0.554 ' N ' HG23 ' A' ' 102' ' ' ILE . 79.5 t80 -60.54 -39.55 88.31 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.275 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 104' ' ' HIS . . . . . 0.482 ' CE1' ' OD2' ' B' ' 210' ' ' ASP . 0.9 OUTLIER -61.19 -41.66 97.19 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.728 179.601 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 33.3 t -73.56 -38.68 65.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.808 179.645 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -64.78 -34.58 78.67 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.637 -179.508 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 74.6 t60 . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.66 -179.807 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 95.1 m-20 . . . . . 0 C--O 1.235 0.321 0 CA-C-O 121.054 0.454 . . . . 0.0 110.384 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 90.9 p -58.81 -34.13 71.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.39 -179.633 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -67.05 -49.04 66.46 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.377 179.582 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 138' ' ' ALA . . . . . 0.503 ' O ' HG23 ' B' ' 142' ' ' VAL . . . -56.87 -36.76 70.44 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 120.845 -0.342 . . . . 0.0 110.232 -179.872 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 139' ' ' ALA . . . . . 0.405 ' HB1' ' HB3' ' A' ' 36' ' ' LEU . . . -66.22 -53.41 37.47 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.498 179.415 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -59.75 -46.02 90.43 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.907 -179.756 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 65.2 tt0 -58.14 -51.08 71.19 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.278 0.561 . . . . 0.0 110.385 -179.777 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 142' ' ' VAL . . . . . 0.503 HG23 ' O ' ' B' ' 138' ' ' ALA . 70.8 t -61.66 -44.96 99.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.992 179.703 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -57.36 -42.6 82.34 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 74.9 m -57.36 -44.11 84.09 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 179.823 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 19.7 m -63.99 -48.52 76.09 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.639 179.437 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 80.3 mt -63.69 -22.55 66.96 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.498 -179.78 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 147' ' ' GLN . . . . . 0.536 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 58.8 tt0 -75.21 -58.43 3.28 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.679 179.374 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -59.96 -54.32 47.51 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.91 -179.308 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.551 ' O ' ' O ' ' B' ' 150' ' ' ALA . 3.9 mm? -48.65 -30.89 5.95 Favored 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 -179.076 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 150' ' ' ALA . . . . . 0.551 ' O ' ' O ' ' B' ' 149' ' ' LEU . . . -56.37 -134.47 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 120.465 -0.494 . . . . 0.0 110.52 179.175 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 151' ' ' THR . . . . . 0.493 ' O ' ' O ' ' B' ' 150' ' ' ALA . 12.3 p 53.62 115.83 0.01 OUTLIER Pre-proline 0 C--N 1.32 -0.677 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.779 -179.804 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_exo -49.07 -44.27 33.47 Favored 'Trans proline' 0 N--CA 1.497 1.701 0 C-N-CA 122.118 1.879 . . . . 0.0 112.991 -179.742 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 6.9 t -59.11 -46.21 88.9 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.94 -178.859 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 16.0 tpp180 -62.96 -36.8 84.67 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.425 -179.715 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 155' ' ' LEU . . . . . 0.464 ' O ' HG23 ' B' ' 159' ' ' THR . 1.9 mm? -62.88 -54.11 43.81 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.384 -0.526 . . . . 0.0 110.821 -179.09 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 156' ' ' MET . . . . . 0.455 ' O ' ' OG1' ' B' ' 159' ' ' THR . 0.0 OUTLIER -57.72 -49.34 76.89 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.063 -0.655 . . . . 0.0 110.614 -179.416 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 157' ' ' ILE . . . . . 0.401 HD13 ' HA ' ' B' ' 157' ' ' ILE . 39.0 mm -62.63 -42.71 97.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-O 121.218 0.533 . . . . 0.0 110.337 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 48.6 tp -62.22 -43.03 99.74 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.769 -179.787 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 159' ' ' THR . . . . . 0.464 HG23 ' O ' ' B' ' 155' ' ' LEU . 23.4 p -60.52 -37.08 80.0 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.913 -0.403 . . . . 0.0 109.913 -179.455 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 75.7 mt-30 -62.71 -46.13 89.57 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.256 -0.577 . . . . 0.0 110.037 179.142 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 161' ' ' LEU . . . . . . . . . . . . . 98.2 mt -64.79 -42.87 94.72 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 120.786 -0.365 . . . . 0.0 110.908 179.63 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 162' ' ' ARG . . . . . 0.525 ' NH1' ' OD1' ' B' ' 218' ' ' ASP . 68.4 ttp85 -51.73 -18.24 1.17 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.395 -179.799 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 61.1 t30 -75.26 -75.05 0.18 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.676 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . -178.42 -141.99 4.55 Favored Glycine 0 CA--C 1.534 1.225 0 C-N-CA 120.487 -0.863 . . . . 0.0 111.199 -179.65 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -49.25 132.77 29.22 Favored 'Trans proline' 0 N--CA 1.493 1.477 0 C-N-CA 122.149 1.899 . . . . 0.0 112.338 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -138.3 67.48 46.37 Favored Pre-proline 0 CA--C 1.536 0.416 0 CA-C-O 121.558 0.694 . . . . 0.0 111.362 -179.856 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -51.97 147.93 24.79 Favored 'Trans proline' 0 C--N 1.298 -2.082 0 C-N-CA 121.772 1.648 . . . . 0.0 111.347 178.24 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . 22.1 t -53.17 -50.39 46.46 Favored 'Isoleucine or valine' 0 C--O 1.237 0.417 0 CA-C-O 121.162 0.505 . . . . 0.0 110.556 -178.296 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 169' ' ' THR . . . . . . . . . . . . . 59.1 p -63.97 -37.8 88.73 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.477 179.274 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -63.57 -41.2 98.4 Favored 'General case' 0 CA--C 1.513 -0.455 0 CA-C-O 121.249 0.547 . . . . 0.0 109.987 179.191 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 171' ' ' LEU . . . . . 0.7 ' C ' HD13 ' B' ' 171' ' ' LEU . 2.8 tm? -61.95 -46.83 87.58 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 119.706 -0.798 . . . . 0.0 109.96 -179.628 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 172' ' ' ALA . . . . . 0.513 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -52.49 -47.85 66.31 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 120.558 -0.457 . . . . 0.0 109.955 179.441 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 44.7 tp10 -54.81 -48.5 72.7 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.425 -0.51 . . . . 0.0 110.531 179.669 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -56.32 -54.93 39.59 Favored 'General case' 0 C--O 1.232 0.157 0 C-N-CA 120.581 -0.448 . . . . 0.0 110.959 -179.352 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 96.3 mt -88.89 -73.91 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.398 179.706 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 176' ' ' GLY . . . . . 0.513 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 132.24 97.53 0.69 Allowed Glycine 0 CA--C 1.523 0.534 0 N-CA-C 111.405 -0.678 . . . . 0.0 111.405 179.824 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 78.3 mtm 58.09 78.06 0.26 Allowed 'General case' 0 CA--C 1.521 -0.148 0 C-N-CA 121.04 -0.264 . . . . 0.0 110.947 179.141 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -174.19 32.23 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.02 0.438 . . . . 0.0 110.115 179.676 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 179' ' ' GLN . . . . . 0.621 ' H ' ' CD ' ' B' ' 179' ' ' GLN . 0.0 OUTLIER -82.21 -25.68 33.98 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.514 -179.017 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 180' ' ' SER . . . . . 0.526 ' O ' ' ND1' ' B' ' 184' ' ' HIS . 34.3 m -65.49 -42.98 91.57 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.589 -179.916 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -69.0 -36.91 78.34 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.633 179.826 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 54.5 t -69.8 -51.84 36.97 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.279 0 C-N-CA 120.501 -0.48 . . . . 0.0 110.785 179.791 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 48.0 t -60.05 -44.94 94.33 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.277 -0.569 . . . . 0.0 110.583 179.606 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 184' ' ' HIS . . . . . 0.588 ' CG ' HH21 ' B' ' 187' ' ' ARG . 0.9 OUTLIER -56.92 -47.61 80.19 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.395 -179.797 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -58.42 -43.07 88.51 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.967 179.699 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 186' ' ' LEU . . . . . 0.519 HD13 HG21 ' B' ' 195' ' ' VAL . 3.3 mm? -60.53 -43.96 96.58 Favored 'General case' 0 CA--C 1.511 -0.535 0 C-N-CA 120.646 -0.421 . . . . 0.0 110.558 -179.723 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 187' ' ' ARG . . . . . 0.588 HH21 ' CG ' ' B' ' 184' ' ' HIS . 86.9 mtm180 -61.32 -40.65 94.98 Favored 'General case' 0 C--N 1.312 -1.043 0 C-N-CA 120.46 -0.496 . . . . 0.0 110.463 -180.0 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 188' ' ' VAL . . . . . 0.494 HG23 ' O ' ' B' ' 184' ' ' HIS . 97.3 t -59.15 -52.36 61.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 C-N-CA 120.352 -0.539 . . . . 0.0 109.701 -179.533 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 189' ' ' LEU . . . . . 0.437 ' N ' HD12 ' B' ' 189' ' ' LEU . 10.9 mp -67.18 -31.81 72.46 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.954 0.407 . . . . 0.0 110.341 179.078 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 190' ' ' ARG . . . . . 0.666 HH12 ' N ' ' B' ' 197' ' ' GLY . 9.6 tpt180 -54.44 -43.49 71.65 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.867 -179.137 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 82.0 m-20 -61.0 -43.59 98.67 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.329 -0.549 . . . . 0.0 110.283 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 192' ' ' LEU . . . . . . . . . . . . . 10.7 mt -64.75 -39.09 93.05 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.948 0.404 . . . . 0.0 110.359 179.815 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 99.12 35.43 4.78 Favored Glycine 0 CA--C 1.524 0.621 0 N-CA-C 111.056 -0.818 . . . . 0.0 111.056 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 17.5 mt -98.7 -18.43 18.04 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.866 0.365 . . . . 0.0 110.773 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 195' ' ' VAL . . . . . 0.519 HG21 HD13 ' B' ' 186' ' ' LEU . 14.1 m -134.39 157.75 41.6 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.268 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.003 -179.912 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 196' ' ' VAL . . . . . 0.484 HG12 ' N ' ' B' ' 197' ' ' GLY . 60.8 t -137.98 158.06 32.77 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.239 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.265 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 197' ' ' GLY . . . . . 0.666 ' N ' HH12 ' B' ' 190' ' ' ARG . . . -135.75 132.69 6.27 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 179.37 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 9.7 t0 . . . . . 0 N--CA 1.463 0.196 0 CA-C-O 120.865 0.364 . . . . 0.0 110.572 179.763 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 89.2 t . . . . . 0 CA--C 1.522 -0.125 0 CA-C-O 120.661 0.267 . . . . 0.0 110.41 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 89.9 m-85 -94.98 127.74 41.26 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.384 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 30.4 p -150.33 165.53 32.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.879 -179.042 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 208' ' ' LEU . . . . . 0.739 HD22 ' N ' ' B' ' 208' ' ' LEU . 2.6 mm? -67.3 147.84 52.45 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.898 -179.186 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 209' ' ' TYR . . . . . 0.469 ' C ' ' CD1' ' B' ' 209' ' ' TYR . 17.0 t80 -59.05 -49.22 78.73 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.405 -179.662 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 210' ' ' ASP . . . . . 0.529 ' OD1' ' N ' ' B' ' 211' ' ' THR . 53.5 t0 -102.63 155.7 18.12 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.602 -179.596 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 211' ' ' THR . . . . . 0.529 ' N ' ' OD1' ' B' ' 210' ' ' ASP . 23.8 p -92.78 -24.24 18.61 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.005 0.431 . . . . 0.0 110.348 179.629 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 212' ' ' HIS . . . . . . . . . . . . . 88.3 m-70 -57.15 -48.14 79.43 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.204 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 213' ' ' VAL . . . . . 0.557 HG13 ' N ' ' B' ' 214' ' ' ALA . 9.6 p -55.35 -44.93 77.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 N-CA-C 109.862 -0.422 . . . . 0.0 109.862 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 214' ' ' ALA . . . . . 0.557 ' N ' HG13 ' B' ' 213' ' ' VAL . . . -54.98 -42.86 72.96 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.186 179.583 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 9.6 tp-100 -61.68 -39.67 92.26 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.093 179.545 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 216' ' ' LEU . . . . . 0.428 ' CD1' ' HB2' ' A' ' 101' ' ' ALA . 15.2 tp -59.89 -43.36 94.85 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.585 -0.446 . . . . 0.0 109.883 -179.489 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 217' ' ' LEU . . . . . 0.444 ' O ' HG22 ' B' ' 221' ' ' ILE . 4.2 mm? -64.32 -37.73 88.53 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.408 179.193 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 218' ' ' ASP . . . . . 0.525 ' OD1' ' NH1' ' B' ' 162' ' ' ARG . 98.6 m-20 -60.44 -39.78 88.75 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.122 0.487 . . . . 0.0 110.408 -179.735 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 219' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -72.84 -47.43 46.31 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.496 -0.482 . . . . 0.0 110.696 179.366 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 220' ' ' ALA . . . . . 0.514 ' HB2' ' CD1' ' A' ' 97' ' ' LEU . . . -62.85 -51.11 68.3 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.888 0.375 . . . . 0.0 111.19 -179.847 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 221' ' ' ILE . . . . . 0.558 HG23 ' N ' ' B' ' 222' ' ' TYR . 10.9 tp -58.65 -47.13 89.69 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.363 -178.931 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 222' ' ' TYR . . . . . 0.558 ' N ' HG23 ' B' ' 221' ' ' ILE . 89.1 t80 -60.24 -39.7 87.64 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.258 179.863 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 223' ' ' HIS . . . . . 0.514 ' CE1' ' OD2' ' A' ' 91' ' ' ASP . 0.9 OUTLIER -60.89 -41.91 96.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.979 179.659 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 6.2 t -73.58 -38.34 65.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.923 0.392 . . . . 0.0 110.889 179.589 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 80.1 tt0 -64.82 -35.14 80.15 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.681 -179.504 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 76.6 t60 . . . . . 0 C--N 1.327 -0.388 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.649 -179.839 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 . . . . . 0 C--O 1.238 0.461 0 CA-C-O 121.321 0.581 . . . . 0.0 111.022 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 87.8 p -57.66 -33.11 67.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.271 -179.646 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 94.1 mm-40 -67.14 -50.73 60.25 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.282 179.752 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.471 ' O ' HG23 ' A' ' 23' ' ' VAL . . . -56.05 -34.83 66.26 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.031 -179.656 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.66 -53.09 24.5 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 121.275 0.56 . . . . 0.0 110.422 179.378 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.96 -46.18 90.25 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.246 179.845 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.477 ' N ' ' OE1' ' A' ' 22' ' ' GLN . 0.9 OUTLIER -60.09 -52.26 66.13 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.037 0.446 . . . . 0.0 110.606 -179.574 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.471 HG23 ' O ' ' A' ' 19' ' ' ALA . 77.5 t -62.3 -46.91 95.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 C-N-CA 120.457 -0.497 . . . . 0.0 110.06 -179.934 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -50.47 -47.91 56.87 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-O 120.99 0.424 . . . . 0.0 110.224 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.5 t -59.38 -42.84 92.58 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.342 179.812 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 95.0 m -61.42 -51.2 69.73 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.766 -179.68 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.45 ' N ' ' CD1' ' A' ' 27' ' ' LEU . 7.6 mp -67.17 -22.14 65.77 Favored 'General case' 0 CA--C 1.523 -0.075 0 CA-C-O 120.763 0.316 . . . . 0.0 110.645 179.759 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.498 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 62.3 tt0 -71.26 -62.48 1.39 Allowed 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.526 179.112 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.414 ' HB1' ' NH1' ' A' ' 35' ' ' ARG . . . -57.25 -53.68 55.42 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 120.753 -0.379 . . . . 0.0 110.591 -179.346 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.493 ' O ' ' O ' ' A' ' 31' ' ' ALA . 85.7 mt -46.54 -31.4 2.75 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.417 -178.985 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.498 ' HB3' ' O ' ' A' ' 28' ' ' GLN . . . -57.06 -127.87 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.423 0 O-C-N 123.667 0.604 . . . . 0.0 110.339 179.522 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.43 ' O ' ' O ' ' A' ' 31' ' ' ALA . 0.5 OUTLIER 53.88 108.26 0.02 OUTLIER Pre-proline 0 CA--C 1.544 0.738 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.592 179.973 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -48.48 -56.01 3.54 Favored 'Trans proline' 0 N--CA 1.494 1.535 0 C-N-CA 122.061 1.841 . . . . 0.0 113.282 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 79.9 p -59.88 -46.19 90.1 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.097 -178.953 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.418 ' HB3' ' HG1' ' A' ' 32' ' ' THR . 35.5 ttm180 -62.78 -43.4 98.91 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.426 -179.786 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.56 HD23 ' O ' ' A' ' 36' ' ' LEU . 1.9 tt -61.46 -53.37 57.4 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.675 -178.785 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 11.0 tpt -51.55 -48.74 62.97 Favored 'General case' 0 C--O 1.242 0.66 0 C-N-CA 120.338 -0.545 . . . . 0.0 110.419 -179.788 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 96.6 mt -60.8 -46.48 96.07 Favored 'Isoleucine or valine' 0 C--O 1.243 0.72 0 CA-C-O 121.545 0.688 . . . . 0.0 110.375 -179.264 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 72.6 mt -59.98 -41.4 91.92 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.14 179.813 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 13.8 m -55.48 -43.08 75.21 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.119 179.698 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 29.1 mm100 -61.52 -44.21 97.47 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.401 -0.52 . . . . 0.0 110.72 179.676 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.569 HD11 ' O ' ' A' ' 87' ' ' TYR . 13.7 tp -68.57 -44.3 74.75 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.335 -0.546 . . . . 0.0 111.323 180.0 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 89.3 mtm-85 -49.18 -17.14 0.2 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.322 -178.879 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.417 ' N ' ' C ' ' A' ' 42' ' ' LEU . 60.9 t-20 -147.06 65.22 1.16 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.086 179.795 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 159.29 82.01 0.04 OUTLIER Glycine 0 CA--C 1.529 0.937 0 N-CA-C 111.121 -0.792 . . . . 0.0 111.121 -179.866 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_exo -69.77 113.34 3.34 Favored 'Trans proline' 0 N--CA 1.497 1.711 0 C-N-CA 123.172 2.581 . . . . 0.0 111.061 178.786 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.554 HD12 ' O ' ' A' ' 47' ' ' LEU . 0.3 OUTLIER -167.15 158.61 10.48 Favored Pre-proline 0 C--N 1.324 -0.531 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.544 -179.171 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -62.71 -171.59 0.11 Allowed 'Trans proline' 0 N--CA 1.497 1.68 0 C-N-CA 122.667 2.245 . . . . 0.0 112.052 178.756 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.548 ' O ' ' N ' ' A' ' 52' ' ' LEU . 46.4 t -75.69 -62.99 1.13 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.353 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.509 -179.918 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.431 ' C ' ' O ' ' A' ' 49' ' ' VAL . 14.5 m -34.7 -49.32 0.41 Allowed 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 121.184 0.516 . . . . 0.0 110.597 -179.268 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -61.79 -44.32 97.12 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.275 178.983 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.61 HD23 ' O ' ' A' ' 52' ' ' LEU . 1.3 tt -62.47 -38.67 90.73 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.773 -179.919 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.12 -42.02 93.86 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.047 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -62.66 -43.96 97.48 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.134 179.791 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.99 -54.95 22.4 Favored 'General case' 0 C--N 1.332 -0.159 0 C-N-CA 120.584 -0.446 . . . . 0.0 110.951 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.682 HG23 ' O ' ' A' ' 56' ' ' ILE . 6.8 tt -176.75 86.45 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.456 -0.133 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.761 -179.863 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' GLY . . . . . 0.508 ' O ' ' N ' ' A' ' 59' ' ' GLU . . . -157.6 -49.79 0.01 OUTLIER Glycine 0 CA--C 1.523 0.544 0 N-CA-C 110.425 -1.07 . . . . 0.0 110.425 178.608 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 99.6 mtp 43.0 17.86 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.747 0.308 . . . . 0.0 110.745 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.508 ' N ' ' O ' ' A' ' 57' ' ' GLY . 95.8 mt-10 -148.31 68.61 1.09 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.152 0.501 . . . . 0.0 109.725 -179.374 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 8.7 mt-30 -58.46 -36.32 73.52 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.798 -179.397 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 37.7 t -62.15 -45.35 93.81 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.777 -179.749 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -61.89 -36.22 80.64 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.293 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 94.0 t -65.41 -50.7 71.21 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 C-N-CA 120.657 -0.417 . . . . 0.0 110.587 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.4 t -57.74 -45.98 85.1 Favored 'General case' 0 C--N 1.332 -0.165 0 C-N-CA 120.722 -0.391 . . . . 0.0 110.331 -179.275 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 48.8 m170 -61.65 -48.0 82.81 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-O 121.191 0.52 . . . . 0.0 110.618 179.803 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 15.6 tt0 -61.83 -40.11 94.14 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.217 -179.903 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.6 tp -62.39 -43.27 99.21 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.232 -179.472 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -60.7 -42.92 98.13 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 120.827 -0.349 . . . . 0.0 110.732 -179.876 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 95.8 t -64.88 -54.19 32.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 C-N-CA 119.898 -0.721 . . . . 0.0 110.674 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 96.6 mt -59.48 -40.34 86.67 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 -178.922 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 62.2 ttp180 -57.97 -41.42 82.91 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.218 179.703 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -58.04 -48.62 79.54 Favored 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 120.596 -0.441 . . . . 0.0 110.539 -179.585 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.536 HD22 ' N ' ' A' ' 73' ' ' LEU . 4.0 mm? -66.36 -41.08 89.98 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.63 179.544 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' GLY . . . . . 0.433 ' C ' HD12 ' A' ' 75' ' ' LEU . . . 107.42 38.83 2.03 Favored Glycine 0 CA--C 1.525 0.671 0 N-CA-C 111.089 -0.805 . . . . 0.0 111.089 -179.812 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.496 ' N ' HD12 ' A' ' 75' ' ' LEU . 9.9 mp -98.86 -13.22 20.16 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 110.446 -0.205 . . . . 0.0 110.446 179.43 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 23.1 m -136.33 155.53 34.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.404 HG23 ' HA ' ' A' ' 90' ' ' TYR . 24.8 t -139.84 150.23 22.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.663 179.847 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -110.67 158.11 14.59 Favored Glycine 0 CA--C 1.523 0.552 0 N-CA-C 110.153 -1.179 . . . . 0.0 110.153 178.905 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 . . . . . 0 CA--C 1.515 -0.378 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 -179.922 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 15.5 m . . . . . 0 N--CA 1.467 0.394 0 CA-C-O 120.751 0.31 . . . . 0.0 110.324 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.569 ' O ' HD11 ' A' ' 42' ' ' LEU . 77.5 m-85 -108.03 136.56 47.52 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.279 -179.729 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 47.5 t -150.63 170.03 20.16 Favored 'General case' 0 CA--C 1.514 -0.439 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.428 ' N ' HD22 ' A' ' 89' ' ' LEU . 4.4 mm? -61.66 153.26 28.57 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.737 179.259 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.404 ' HA ' HG23 ' A' ' 77' ' ' VAL . 65.5 t80 -50.51 -45.83 56.83 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.485 179.953 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.498 ' OD2' ' CG ' ' A' ' 93' ' ' HIS . 28.3 t70 -156.88 168.41 27.55 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.937 -0.305 . . . . 0.0 110.507 179.88 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 92' ' ' THR . . . . . 0.538 ' O ' ' HB3' ' A' ' 95' ' ' ALA . 64.1 p -68.88 -32.28 71.82 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.838 -179.999 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 93' ' ' HIS . . . . . 0.498 ' CG ' ' OD2' ' A' ' 91' ' ' ASP . 27.3 m170 -39.46 -67.79 0.2 Allowed 'General case' 0 C--O 1.24 0.56 0 CA-C-O 121.34 0.591 . . . . 0.0 110.716 -179.9 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 57.7 t -45.73 -40.42 3.22 Favored 'Isoleucine or valine' 0 C--O 1.236 0.395 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.32 179.744 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.538 ' HB3' ' O ' ' A' ' 92' ' ' THR . . . -61.49 -38.09 86.04 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.31 -179.989 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -60.74 -44.99 95.98 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.303 0.573 . . . . 0.0 110.028 -179.653 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.518 ' N ' ' CD1' ' A' ' 97' ' ' LEU . 6.4 mp -61.51 -46.32 90.48 Favored 'General case' 0 C--O 1.24 0.592 0 CA-C-O 121.522 0.677 . . . . 0.0 110.193 -179.467 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 17.7 mt -66.61 -33.86 76.59 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.259 179.494 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 91.7 m-20 -59.87 -42.48 93.78 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 -179.597 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -65.45 -48.68 71.85 Favored 'General case' 0 N--CA 1.462 0.149 0 N-CA-C 109.819 -0.438 . . . . 0.0 109.819 179.458 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.26 -44.82 96.63 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.946 179.439 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 5.3 mm -63.63 -46.17 95.56 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.932 -179.824 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 90.2 t80 -63.78 -50.78 67.65 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 120.711 -0.396 . . . . 0.0 110.643 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 56.7 t-80 -59.93 -33.9 72.51 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.677 -179.617 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 7.5 t -76.06 -50.37 14.93 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.866 0.365 . . . . 0.0 111.323 179.898 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -64.81 -22.03 66.9 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.534 -179.733 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 34.5 t60 . . . . . 0 N--CA 1.452 -0.33 0 C-N-CA 120.551 -0.46 . . . . 0.0 110.524 -179.048 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 . . . . . 0 N--CA 1.469 0.477 0 CA-C-O 121.056 0.455 . . . . 0.0 111.056 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 77.5 p -56.77 -45.66 81.96 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.176 179.237 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 95.5 mm-40 -62.56 -45.73 91.57 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.306 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 138' ' ' ALA . . . . . 0.523 ' O ' HG23 ' B' ' 142' ' ' VAL . . . -56.64 -34.29 67.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.277 -179.886 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.7 -53.26 23.22 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-O 121.045 0.45 . . . . 0.0 110.419 179.394 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -60.17 -46.65 88.96 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 120.604 -0.438 . . . . 0.0 111.356 179.924 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 141' ' ' GLN . . . . . 0.511 ' N ' ' OE1' ' B' ' 141' ' ' GLN . 0.8 OUTLIER -59.29 -52.57 65.07 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.114 0.483 . . . . 0.0 110.767 -179.439 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 142' ' ' VAL . . . . . 0.523 HG23 ' O ' ' B' ' 138' ' ' ALA . 96.7 t -62.05 -47.09 94.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 C-N-CA 120.395 -0.522 . . . . 0.0 110.113 -179.8 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -50.85 -47.26 60.32 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 120.931 0.396 . . . . 0.0 110.322 -179.649 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 14.4 t -59.28 -42.33 90.99 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.019 179.78 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 96.4 m -62.57 -51.61 66.66 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.406 -0.518 . . . . 0.0 110.806 -179.95 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 146' ' ' LEU . . . . . 0.423 ' N ' ' CD1' ' B' ' 146' ' ' LEU . 7.8 mp -66.24 -22.62 66.33 Favored 'General case' 0 CA--C 1.523 -0.096 0 CA-C-O 120.807 0.337 . . . . 0.0 110.653 179.602 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 147' ' ' GLN . . . . . 0.495 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 62.4 tt0 -70.89 -63.28 1.13 Allowed 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.593 179.262 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -56.85 -53.28 59.71 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 120.691 -0.404 . . . . 0.0 110.924 -179.297 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.494 ' O ' ' O ' ' B' ' 150' ' ' ALA . 88.9 mt -46.5 -31.0 2.47 Favored 'General case' 0 CA--C 1.511 -0.548 0 C-N-CA 120.956 -0.298 . . . . 0.0 110.503 -179.106 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 150' ' ' ALA . . . . . 0.495 ' HB3' ' O ' ' B' ' 147' ' ' GLN . . . -57.57 -128.58 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.454 0 O-C-N 123.54 0.525 . . . . 0.0 110.517 179.511 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 151' ' ' THR . . . . . 0.436 ' O ' ' O ' ' B' ' 150' ' ' ALA . 0.6 OUTLIER 53.81 107.39 0.02 OUTLIER Pre-proline 0 CA--C 1.543 0.677 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.554 179.946 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -47.9 -59.25 1.32 Allowed 'Trans proline' 0 N--CA 1.494 1.533 0 C-N-CA 122.122 1.881 . . . . 0.0 113.338 -179.811 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 78.2 p -56.6 -46.6 80.78 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.055 -178.76 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 154' ' ' ARG . . . . . 0.401 ' HB3' ' HG1' ' B' ' 151' ' ' THR . 36.1 ttm180 -62.4 -43.33 99.07 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.451 179.795 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 155' ' ' LEU . . . . . 0.53 HD23 ' O ' ' B' ' 155' ' ' LEU . 1.8 tt -61.05 -53.88 51.75 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 120.468 -0.493 . . . . 0.0 110.582 -178.733 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 11.0 tpt -51.16 -48.86 61.78 Favored 'General case' 0 C--O 1.24 0.584 0 C-N-CA 120.178 -0.609 . . . . 0.0 110.425 -179.741 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 96.3 mt -59.94 -47.33 92.07 Favored 'Isoleucine or valine' 0 C--O 1.244 0.785 0 CA-C-O 121.715 0.769 . . . . 0.0 110.29 -179.417 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 75.3 mt -59.11 -41.89 89.24 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.053 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 13.6 m -54.77 -43.53 72.88 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.354 179.718 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 28.6 mm100 -60.72 -44.68 96.32 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.393 -0.523 . . . . 0.0 110.574 179.725 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 161' ' ' LEU . . . . . 0.589 HD11 ' O ' ' B' ' 206' ' ' TYR . 13.4 tp -68.43 -43.73 76.47 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.351 -0.54 . . . . 0.0 111.401 179.887 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 162' ' ' ARG . . . . . . . . . . . . . 88.5 mtm-85 -50.04 -19.63 0.77 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.355 -178.8 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 55.3 t-20 -142.89 64.81 1.35 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.057 179.836 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . 156.81 88.72 0.07 OUTLIER Glycine 0 CA--C 1.539 1.579 0 N-CA-C 110.978 -0.849 . . . . 0.0 110.978 179.886 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -77.87 113.98 3.55 Favored 'Trans proline' 0 N--CA 1.496 1.639 0 C-N-CA 122.518 2.145 . . . . 0.0 110.966 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 166' ' ' LEU . . . . . 0.547 ' O ' HD12 ' B' ' 166' ' ' LEU . 0.3 OUTLIER -164.98 158.29 14.29 Favored Pre-proline 0 C--N 1.325 -0.462 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.711 -178.663 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_endo -61.08 -172.02 0.08 OUTLIER 'Trans proline' 0 N--CA 1.496 1.621 0 C-N-CA 122.871 2.381 . . . . 0.0 112.1 178.908 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 168' ' ' VAL . . . . . 0.554 ' O ' ' N ' ' B' ' 171' ' ' LEU . 47.1 t -75.39 -62.85 1.18 Allowed 'Isoleucine or valine' 0 C--O 1.224 -0.282 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.504 -179.786 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 169' ' ' THR . . . . . 0.423 ' C ' ' O ' ' B' ' 168' ' ' VAL . 17.3 m -34.58 -48.72 0.38 Allowed 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 121.126 0.488 . . . . 0.0 110.624 -179.157 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -62.44 -44.14 97.14 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.285 178.988 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 171' ' ' LEU . . . . . 0.602 HD23 ' O ' ' B' ' 171' ' ' LEU . 1.2 tt -62.37 -39.32 92.79 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.226 0.536 . . . . 0.0 109.812 -179.819 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 172' ' ' ALA . . . . . . . . . . . . . . . -60.7 -42.29 96.91 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.328 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -62.25 -43.02 99.78 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.112 179.777 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -66.76 -54.54 21.78 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.587 -0.445 . . . . 0.0 110.931 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 175' ' ' ILE . . . . . 0.687 ' O ' HG23 ' B' ' 175' ' ' ILE . 8.8 tt -176.97 86.97 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.456 -0.147 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.719 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 176' ' ' GLY . . . . . 0.533 ' O ' ' N ' ' B' ' 178' ' ' GLU . . . -157.56 -49.0 0.01 OUTLIER Glycine 0 CA--C 1.522 0.471 0 N-CA-C 110.528 -1.029 . . . . 0.0 110.528 178.611 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 97.6 mtp 41.81 19.42 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.139 0 CA-C-O 120.787 0.327 . . . . 0.0 110.755 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 178' ' ' GLU . . . . . 0.533 ' N ' ' O ' ' B' ' 176' ' ' GLY . 94.3 mt-10 -150.06 67.05 0.97 Allowed 'General case' 0 CA--C 1.52 -0.195 0 CA-C-O 121.049 0.452 . . . . 0.0 109.989 -179.342 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 9.1 mt-30 -57.09 -37.28 71.67 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.863 -179.64 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 44.5 t -61.97 -45.95 91.42 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.805 -179.76 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -61.62 -36.4 80.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.404 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 95.5 t -64.91 -50.71 73.79 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 C-N-CA 120.593 -0.443 . . . . 0.0 110.656 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 12.0 t -58.31 -45.23 88.43 Favored 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.086 -178.864 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 46.6 m170 -61.67 -47.67 84.29 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-O 121.209 0.528 . . . . 0.0 110.656 179.591 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 16.5 tt0 -62.1 -40.21 95.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.234 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 186' ' ' LEU . . . . . 0.418 HD21 ' CD1' ' B' ' 206' ' ' TYR . 6.9 tp -62.63 -43.2 99.4 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.404 -179.658 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -60.2 -42.8 95.86 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.754 -0.379 . . . . 0.0 110.315 179.912 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 73.9 t -64.69 -54.39 30.75 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.211 0 C-N-CA 119.898 -0.721 . . . . 0.0 110.558 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 189' ' ' LEU . . . . . 0.402 HD23 ' HA ' ' B' ' 189' ' ' LEU . 98.5 mt -59.67 -40.95 89.49 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 -178.704 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 62.1 ttp180 -56.95 -42.25 79.74 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.29 179.775 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 40.6 t30 -57.03 -50.79 71.66 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.586 -0.446 . . . . 0.0 110.487 -179.671 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 192' ' ' LEU . . . . . 0.532 ' N ' HD22 ' B' ' 192' ' ' LEU . 3.9 mm? -64.45 -41.69 96.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.646 179.819 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 193' ' ' GLY . . . . . 0.419 ' C ' HD12 ' B' ' 194' ' ' LEU . . . 107.89 38.01 2.09 Favored Glycine 0 CA--C 1.524 0.613 0 N-CA-C 111.13 -0.788 . . . . 0.0 111.13 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 194' ' ' LEU . . . . . 0.506 ' N ' HD12 ' B' ' 194' ' ' LEU . 9.8 mp -97.49 -12.97 22.01 Favored 'General case' 0 N--CA 1.466 0.371 0 O-C-N 122.766 -0.255 . . . . 0.0 110.394 179.355 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 26.2 m -137.21 156.23 33.43 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.384 0 N-CA-C 109.981 -0.378 . . . . 0.0 109.981 -179.878 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 196' ' ' VAL . . . . . . . . . . . . . 29.9 t -141.42 152.55 19.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.451 179.583 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 197' ' ' GLY . . . . . . . . . . . . . . . -112.1 160.65 13.06 Favored Glycine 0 CA--C 1.522 0.509 0 N-CA-C 110.379 -1.088 . . . . 0.0 110.379 179.365 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 95.3 m-20 . . . . . 0 CA--C 1.515 -0.392 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 -179.997 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 12.3 m . . . . . 0 N--CA 1.468 0.435 0 CA-C-O 120.8 0.333 . . . . 0.0 110.327 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 206' ' ' TYR . . . . . 0.589 ' O ' HD11 ' B' ' 161' ' ' LEU . 79.7 m-85 -108.53 137.22 46.84 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.303 -179.813 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 40.1 t -150.75 169.93 20.45 Favored 'General case' 0 C--O 1.222 -0.391 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 208' ' ' LEU . . . . . 0.427 HD22 ' N ' ' B' ' 208' ' ' LEU . 4.4 mm? -62.27 153.69 29.96 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.718 179.23 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -50.51 -46.77 57.37 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.479 179.761 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 210' ' ' ASP . . . . . 0.523 ' OD2' ' CG ' ' B' ' 212' ' ' HIS . 31.5 t70 -156.42 166.14 34.3 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.911 0.386 . . . . 0.0 110.485 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 211' ' ' THR . . . . . 0.561 ' O ' ' HB3' ' B' ' 214' ' ' ALA . 74.1 p -67.27 -32.09 72.87 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.622 -179.773 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 212' ' ' HIS . . . . . 0.523 ' CG ' ' OD2' ' B' ' 210' ' ' ASP . 29.9 m170 -39.46 -67.49 0.22 Allowed 'General case' 0 C--O 1.238 0.457 0 CA-C-O 121.308 0.575 . . . . 0.0 110.779 -179.936 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 59.3 t -45.99 -39.24 3.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.336 179.561 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 214' ' ' ALA . . . . . 0.561 ' HB3' ' O ' ' B' ' 211' ' ' THR . . . -62.49 -38.18 88.87 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.339 179.83 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 57.5 tt0 -60.44 -44.89 95.36 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.247 0.546 . . . . 0.0 109.994 -179.743 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 216' ' ' LEU . . . . . 0.524 ' CD1' ' N ' ' B' ' 216' ' ' LEU . 6.3 mp -61.99 -45.73 92.35 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-O 121.431 0.634 . . . . 0.0 110.39 -179.567 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 67.1 mt -66.55 -34.97 79.09 Favored 'General case' 0 C--O 1.218 -0.571 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.118 179.444 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -60.07 -42.67 95.06 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 -179.735 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 219' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -64.6 -47.79 77.3 Favored 'General case' 0 CA--C 1.52 -0.187 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 179.429 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 220' ' ' ALA . . . . . 0.414 ' HA ' HD21 ' A' ' 97' ' ' LEU . . . -62.94 -44.42 96.11 Favored 'General case' 0 CA--C 1.518 -0.262 0 C-N-CA 120.643 -0.423 . . . . 0.0 111.098 179.28 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 5.2 mm -63.93 -45.68 96.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 C-N-CA 120.729 -0.388 . . . . 0.0 110.98 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 89.7 t80 -63.65 -50.35 69.65 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.564 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 223' ' ' HIS . . . . . . . . . . . . . 52.0 t-80 -60.58 -33.34 72.58 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.691 -179.721 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 10.6 t -76.4 -50.79 13.26 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.918 0.39 . . . . 0.0 111.501 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -64.34 -24.16 67.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.705 -179.793 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 32.9 t60 . . . . . 0 C--N 1.33 -0.277 0 C-N-CA 120.552 -0.459 . . . . 0.0 110.476 -179.18 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ASP . . . . . 0.431 ' O ' ' OD1' ' A' ' 16' ' ' ASP . 66.8 t0 . . . . . 0 N--CA 1.464 0.273 0 CA-C-O 120.953 0.406 . . . . 0.0 110.769 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 83.8 p -45.25 -50.78 11.49 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.147 179.246 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 62.3 tt0 -63.44 -42.18 98.66 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.078 179.739 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.463 ' O ' HG23 ' A' ' 23' ' ' VAL . . . -57.49 -35.57 70.38 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.25 179.714 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.64 -53.47 33.69 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 110.181 -0.303 . . . . 0.0 110.181 179.573 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.46 -40.42 94.44 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.682 -179.644 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -61.33 -52.42 64.74 Favored 'General case' 0 C--O 1.242 0.704 0 CA-C-O 121.265 0.555 . . . . 0.0 110.48 -179.883 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.463 HG23 ' O ' ' A' ' 19' ' ' ALA . 83.5 t -62.18 -46.19 97.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.052 179.616 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -52.93 -43.63 66.41 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 120.87 -0.332 . . . . 0.0 110.207 179.748 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.9 t -59.16 -43.23 92.08 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.234 -0.439 . . . . 0.0 109.927 179.879 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 97.2 m -62.43 -51.47 67.41 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 120.539 -0.464 . . . . 0.0 110.532 179.729 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.46 ' N ' ' CD1' ' A' ' 27' ' ' LEU . 7.5 mp -65.51 -20.46 66.35 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 116.563 -0.289 . . . . 0.0 110.68 179.61 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.516 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 58.8 tt0 -74.04 -60.99 2.01 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.504 179.577 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.447 ' HB1' HH12 ' A' ' 35' ' ' ARG . . . -59.68 -54.43 46.53 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.802 -179.385 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.531 HD13 HD13 ' A' ' 39' ' ' LEU . 4.0 mm? -47.73 -30.44 3.87 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.187 -179.205 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.516 ' HB3' ' O ' ' A' ' 28' ' ' GLN . . . -58.9 -141.4 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.231 0.539 . . . . 0.0 110.453 179.661 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.407 ' O ' ' O ' ' A' ' 31' ' ' ALA . 3.3 m 59.48 115.76 0.02 OUTLIER Pre-proline 0 CA--C 1.541 0.609 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.149 -179.882 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -47.86 -53.15 7.02 Favored 'Trans proline' 0 C--N 1.31 -1.486 0 C-N-CA 122.306 2.004 . . . . 0.0 113.34 -179.068 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 78.0 p -53.01 -48.17 67.75 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.085 -178.576 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.447 HH12 ' HB1' ' A' ' 29' ' ' ALA . 82.8 mtp180 -67.77 -37.88 82.68 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 120.812 -0.355 . . . . 0.0 110.497 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.498 HD13 ' O ' ' A' ' 36' ' ' LEU . 0.2 OUTLIER -60.74 -52.76 63.73 Favored 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 120.25 -0.58 . . . . 0.0 110.86 -178.289 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.615 ' SD ' HD11 ' A' ' 56' ' ' ILE . 5.3 ttt -62.06 -48.12 81.67 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.755 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 94.7 mt -60.63 -45.65 97.04 Favored 'Isoleucine or valine' 0 C--O 1.243 0.741 0 CA-C-O 121.328 0.585 . . . . 0.0 110.481 -179.491 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.531 HD13 HD13 ' A' ' 30' ' ' LEU . 43.9 mt -60.68 -40.63 92.85 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.319 179.524 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 19.3 m -59.32 -43.17 92.71 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.024 179.062 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 67.0 tp60 -54.97 -47.03 75.1 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-O 120.984 0.421 . . . . 0.0 109.94 179.863 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.404 ' HA ' HD23 ' A' ' 42' ' ' LEU . 27.9 mt -65.89 -38.47 88.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.928 179.249 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 53.8 ttp180 -54.75 -44.08 73.3 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.09 -178.965 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -134.27 62.09 1.66 Allowed 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.844 0.354 . . . . 0.0 110.21 179.651 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 177.18 80.24 0.05 OUTLIER Glycine 0 CA--C 1.533 1.202 0 N-CA-C 110.686 -0.966 . . . . 0.0 110.686 -179.931 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -77.56 104.91 1.95 Allowed 'Trans proline' 0 N--CA 1.494 1.536 0 C-N-CA 122.491 2.128 . . . . 0.0 111.861 -179.365 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.524 ' H ' HD12 ' A' ' 47' ' ' LEU . 0.2 OUTLIER -155.88 156.43 30.54 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.342 -179.414 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -65.45 175.51 4.14 Favored 'Trans proline' 0 C--N 1.308 -1.595 0 C-N-CA 122.83 2.353 . . . . 0.0 111.975 179.633 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.545 HG23 ' N ' ' A' ' 50' ' ' THR . 5.1 m -63.91 -43.85 97.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.383 0.611 . . . . 0.0 110.994 -179.743 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.545 ' N ' HG23 ' A' ' 49' ' ' VAL . 0.2 OUTLIER -58.08 -65.78 0.59 Allowed 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.359 -179.718 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.467 ' H ' HG23 ' A' ' 50' ' ' THR . 41.2 t0 -50.68 -36.49 36.14 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 -179.61 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 9.5 tt -63.12 -41.51 99.34 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.31 179.317 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.26 -42.76 99.62 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-O 120.896 0.379 . . . . 0.0 110.241 -179.573 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -62.41 -41.72 98.9 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.113 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -66.68 -52.94 39.05 Favored 'General case' 0 CA--C 1.521 -0.157 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.847 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.718 HG23 ' O ' ' A' ' 56' ' ' ILE . 7.7 tt -175.07 84.1 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.881 -179.871 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -167.01 -59.29 0.03 OUTLIER Glycine 0 CA--C 1.525 0.688 0 N-CA-C 110.523 -1.031 . . . . 0.0 110.523 178.684 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 70.7 mtm 54.0 29.93 10.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.867 0.365 . . . . 0.0 110.451 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.522 ' O ' ' N ' ' A' ' 61' ' ' SER . 19.9 pt-20 -163.99 39.54 0.09 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.593 -179.879 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -40.54 -22.99 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.588 179.692 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.531 ' O ' ' ND1' ' A' ' 65' ' ' HIS . 78.0 p -67.84 -42.55 81.22 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.387 179.883 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.469 ' N ' ' O ' ' A' ' 59' ' ' GLU . . . -66.23 -35.15 79.68 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.313 179.539 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 92.1 t -66.99 -47.94 80.85 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.645 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 75.4 m -60.23 -43.14 96.29 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 120.926 -0.31 . . . . 0.0 110.473 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' HIS . . . . . 0.531 ' ND1' ' O ' ' A' ' 61' ' ' SER . 35.3 m80 -63.72 -49.94 71.09 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.608 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 93.9 mt-30 -63.71 -37.65 88.15 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.315 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 5.0 tt -62.28 -44.96 95.33 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.549 179.953 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 19.4 mmm180 -61.92 -41.93 98.5 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.839 0.352 . . . . 0.0 110.39 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 88.9 t -62.7 -55.13 25.67 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.133 0 C-N-CA 119.993 -0.683 . . . . 0.0 110.066 -179.838 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 81.2 mt -60.86 -35.47 76.68 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.29 -0.414 . . . . 0.0 109.948 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -57.83 -42.03 83.5 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.361 179.843 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -59.68 -45.9 90.7 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.497 -0.481 . . . . 0.0 110.383 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.547 HD22 ' N ' ' A' ' 73' ' ' LEU . 3.9 mm? -67.87 -41.8 82.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.762 179.505 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 109.76 91.77 2.15 Favored Glycine 0 CA--C 1.522 0.531 0 N-CA-C 110.953 -0.859 . . . . 0.0 110.953 -179.66 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 55.2 tp -156.84 -25.81 0.09 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.755 0.312 . . . . 0.0 110.577 179.401 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 19.2 m -136.98 158.82 36.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.46 179.833 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.481 HG12 ' N ' ' A' ' 78' ' ' GLY . 71.5 t -143.85 157.33 16.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.393 -179.761 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' GLY . . . . . 0.481 ' N ' HG12 ' A' ' 77' ' ' VAL . . . -124.22 143.4 14.77 Favored Glycine 0 N--CA 1.462 0.382 0 N-CA-C 110.385 -1.086 . . . . 0.0 110.385 179.169 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 . . . . . 0 CA--C 1.514 -0.408 0 N-CA-C 110.024 -0.361 . . . . 0.0 110.024 -179.557 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 60.2 t . . . . . 0 N--CA 1.465 0.278 0 CA-C-O 120.864 0.364 . . . . 0.0 110.791 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 43.0 m-85 -100.38 132.9 45.5 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.298 178.795 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 48.2 t -150.73 170.97 17.93 Favored 'General case' 0 C--N 1.338 0.095 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.063 -179.907 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 47.2 mt -71.03 149.85 46.18 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.457 -179.718 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.421 ' O ' ' OD1' ' A' ' 91' ' ' ASP . 1.5 t80 -52.68 -51.34 60.65 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.485 -179.471 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.421 ' OD1' ' O ' ' A' ' 90' ' ' TYR . 98.9 m-20 -139.34 -171.15 3.06 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.412 -179.527 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 66.0 p -96.62 9.14 42.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.458 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 18.1 t-160 -52.39 -67.59 0.24 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.468 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 28.6 m -63.29 -34.35 66.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.34 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -56.46 -51.2 69.33 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.621 -179.839 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 -65.11 -42.92 93.54 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.26 179.781 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.605 ' CD1' ' HB2' ' B' ' 220' ' ' ALA . 14.4 tp -60.16 -46.64 89.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.169 0.509 . . . . 0.0 110.275 -179.66 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 71.2 mt -63.86 -37.98 89.4 Favored 'General case' 0 C--O 1.221 -0.415 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.251 179.515 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 66.1 t0 -59.47 -44.46 93.01 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.315 -179.705 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.445 ' O ' ' CG ' ' A' ' 104' ' ' HIS . 15.5 mm-40 -64.71 -50.22 67.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.7 -179.988 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 101' ' ' ALA . . . . . 0.56 ' HB2' ' CD1' ' B' ' 216' ' ' LEU . . . -63.81 -40.45 96.66 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.415 -179.907 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 4.3 mm -63.75 -48.22 87.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.751 -179.037 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -67.11 -43.57 82.14 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.364 -179.71 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 104' ' ' HIS . . . . . 0.445 ' CG ' ' O ' ' A' ' 100' ' ' GLU . 58.1 m170 -62.76 -41.01 99.02 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.613 -179.422 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 23.3 t -76.21 -42.39 46.26 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.888 0.375 . . . . 0.0 110.923 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 85.0 tt0 -62.89 -28.8 70.29 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.547 -179.615 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 84.8 t60 . . . . . 0 C--N 1.331 -0.222 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.193 -179.073 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 135' ' ' ASP . . . . . 0.42 ' O ' ' OD1' ' B' ' 135' ' ' ASP . 67.7 t0 . . . . . 0 N--CA 1.464 0.269 0 CA-C-O 121.003 0.43 . . . . 0.0 110.668 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 57.4 p -45.55 -50.82 12.69 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.252 179.107 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 63.4 tt0 -63.94 -42.52 97.3 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.074 179.681 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 138' ' ' ALA . . . . . 0.496 ' O ' HG23 ' B' ' 142' ' ' VAL . . . -56.74 -35.61 68.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.207 179.832 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -66.69 -52.83 40.21 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 179.37 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -61.48 -40.33 94.14 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.71 -179.676 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -61.79 -52.02 65.92 Favored 'General case' 0 C--O 1.242 0.665 0 CA-C-O 121.233 0.54 . . . . 0.0 110.53 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 142' ' ' VAL . . . . . 0.496 HG23 ' O ' ' B' ' 138' ' ' ALA . 90.3 t -62.18 -46.12 97.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.024 179.611 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -52.89 -43.26 66.04 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 120.86 0.362 . . . . 0.0 110.256 179.693 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 11.6 t -59.47 -43.34 93.26 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.006 179.782 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 26.7 m -62.87 -50.98 68.78 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 120.586 -0.446 . . . . 0.0 110.589 179.466 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 146' ' ' LEU . . . . . 0.45 ' N ' ' CD1' ' B' ' 146' ' ' LEU . 7.7 mp -65.86 -20.56 66.28 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.69 -0.232 . . . . 0.0 110.773 179.643 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 147' ' ' GLN . . . . . 0.531 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 59.3 tt0 -74.51 -59.79 2.57 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.604 179.434 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -60.43 -55.05 38.24 Favored 'General case' 0 CA--C 1.522 -0.117 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.8 -179.263 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 149' ' ' LEU . . . . . 0.514 HD13 HD13 ' B' ' 158' ' ' LEU . 3.9 mm? -47.62 -29.53 3.0 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.239 -179.341 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 150' ' ' ALA . . . . . 0.531 ' HB3' ' O ' ' B' ' 147' ' ' GLN . . . -59.33 -143.51 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.203 0.525 . . . . 0.0 110.308 179.422 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 151' ' ' THR . . . . . . . . . . . . . 2.6 m 61.67 116.06 0.02 OUTLIER Pre-proline 0 C--N 1.322 -0.602 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.167 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_exo -48.4 -52.0 9.2 Favored 'Trans proline' 0 C--N 1.31 -1.496 0 C-N-CA 122.319 2.013 . . . . 0.0 113.364 -179.011 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 78.0 p -54.64 -48.4 72.31 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.027 -178.43 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 82.3 mtp180 -67.17 -37.73 84.22 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 120.853 -0.339 . . . . 0.0 110.588 -179.824 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 155' ' ' LEU . . . . . 0.518 ' O ' HD13 ' B' ' 155' ' ' LEU . 0.2 OUTLIER -60.73 -53.39 57.95 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 120.431 -0.508 . . . . 0.0 110.802 -178.491 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 156' ' ' MET . . . . . 0.568 ' SD ' HD11 ' B' ' 175' ' ' ILE . 4.5 ttt -61.06 -47.14 87.71 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.782 -179.851 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 96.1 mt -61.47 -44.56 98.77 Favored 'Isoleucine or valine' 0 C--O 1.243 0.749 0 CA-C-O 121.399 0.618 . . . . 0.0 110.356 -179.574 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 158' ' ' LEU . . . . . 0.514 HD13 HD13 ' B' ' 149' ' ' LEU . 33.7 mt -61.89 -40.13 94.35 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.151 179.901 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 16.2 m -60.47 -41.53 94.34 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.055 -0.521 . . . . 0.0 109.829 179.386 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 68.2 tp60 -57.06 -46.86 82.13 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.918 179.943 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 161' ' ' LEU . . . . . 0.421 HD23 ' HA ' ' B' ' 161' ' ' LEU . 32.6 mt -66.26 -38.6 88.22 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.836 179.376 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 162' ' ' ARG . . . . . 0.41 HH12 HG13 ' B' ' 221' ' ' ILE . 55.9 ttp180 -55.12 -43.76 74.39 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.226 -178.959 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -134.67 64.59 1.59 Allowed 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.948 0.404 . . . . 0.0 110.204 179.704 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . 173.8 77.58 0.05 OUTLIER Glycine 0 CA--C 1.531 1.037 0 N-CA-C 110.774 -0.931 . . . . 0.0 110.774 -179.762 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -75.35 106.4 2.26 Favored 'Trans proline' 0 N--CA 1.494 1.536 0 C-N-CA 122.547 2.165 . . . . 0.0 111.677 -179.541 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 166' ' ' LEU . . . . . 0.537 ' O ' HD12 ' B' ' 166' ' ' LEU . 0.3 OUTLIER -158.41 154.45 23.58 Favored Pre-proline 0 C--N 1.325 -0.5 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.425 -179.342 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -64.6 176.89 2.51 Favored 'Trans proline' 0 C--N 1.309 -1.52 0 C-N-CA 122.834 2.356 . . . . 0.0 112.218 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 168' ' ' VAL . . . . . 0.571 HG23 ' N ' ' B' ' 169' ' ' THR . 4.3 m -67.51 -45.52 85.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.885 -179.815 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 169' ' ' THR . . . . . 0.571 ' N ' HG23 ' B' ' 168' ' ' VAL . 0.0 OUTLIER -57.63 -41.35 81.17 Favored 'General case' 0 C--O 1.246 0.9 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.349 -179.632 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 38.0 t0 -72.67 -37.81 67.81 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.527 178.927 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 8.6 tt -64.39 -38.41 90.92 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.171 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 172' ' ' ALA . . . . . . . . . . . . . . . -63.81 -45.31 90.2 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.264 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -60.91 -42.37 97.93 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.342 -0.543 . . . . 0.0 110.292 179.67 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -67.7 -52.28 39.61 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.927 -179.463 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 175' ' ' ILE . . . . . 0.695 ' O ' HG23 ' B' ' 175' ' ' ILE . 4.8 tt -174.57 85.7 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.771 -179.745 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . -168.71 -61.38 0.03 OUTLIER Glycine 0 C--N 1.315 -0.596 0 N-CA-C 110.527 -1.029 . . . . 0.0 110.527 178.532 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 64.5 mtm 56.17 29.61 15.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.792 0.329 . . . . 0.0 110.492 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 178' ' ' GLU . . . . . 0.525 ' O ' ' N ' ' B' ' 180' ' ' SER . 20.8 pt-20 -163.19 39.93 0.1 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.625 -179.816 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 179' ' ' GLN . . . . . 0.406 ' HG2' ' H ' ' B' ' 179' ' ' GLN . 1.1 pt20 -40.75 -22.4 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.561 179.738 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 180' ' ' SER . . . . . 0.525 ' N ' ' O ' ' B' ' 178' ' ' GLU . 77.3 p -68.41 -42.68 78.65 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.383 179.686 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 181' ' ' ALA . . . . . 0.478 ' N ' ' O ' ' B' ' 178' ' ' GLU . . . -66.16 -35.56 80.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.348 179.556 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 99.0 t -66.96 -48.07 80.53 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.643 179.884 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 69.6 m -60.02 -43.44 95.27 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.841 0.353 . . . . 0.0 110.517 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 184' ' ' HIS . . . . . 0.512 ' ND1' ' O ' ' B' ' 180' ' ' SER . 33.8 m80 -63.37 -50.27 70.56 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-O 121.155 0.502 . . . . 0.0 110.739 -179.817 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 -63.62 -36.83 85.11 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.41 179.667 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 5.6 tt -62.47 -44.51 96.23 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.548 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 19.0 mmm180 -62.73 -42.15 99.52 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.863 0.363 . . . . 0.0 110.412 -179.833 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 71.5 t -62.13 -55.5 23.68 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 C-N-CA 119.989 -0.684 . . . . 0.0 110.066 -179.87 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 83.8 mt -60.67 -34.78 74.83 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.809 -0.441 . . . . 0.0 109.809 -179.629 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 76.3 ttt180 -58.13 -42.12 85.15 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.43 179.783 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -60.42 -46.47 89.91 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.582 -0.447 . . . . 0.0 110.445 -179.867 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 192' ' ' LEU . . . . . 0.538 ' N ' HD22 ' B' ' 192' ' ' LEU . 3.9 mm? -66.97 -41.69 86.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.658 179.56 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 109.14 93.38 2.27 Favored Glycine 0 CA--C 1.522 0.471 0 N-CA-C 110.85 -0.9 . . . . 0.0 110.85 -179.631 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 52.3 tp -158.83 -25.27 0.08 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.845 0.355 . . . . 0.0 110.542 179.491 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 24.1 m -137.95 159.82 33.35 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.346 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.407 179.85 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 196' ' ' VAL . . . . . 0.519 HG12 ' N ' ' B' ' 197' ' ' GLY . 73.8 t -145.35 159.16 13.13 Favored 'Isoleucine or valine' 0 C--O 1.232 0.137 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.361 -179.873 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 197' ' ' GLY . . . . . 0.519 ' N ' HG12 ' B' ' 196' ' ' VAL . . . -125.97 143.41 14.41 Favored Glycine 0 N--CA 1.463 0.45 0 N-CA-C 110.463 -1.055 . . . . 0.0 110.463 179.34 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 95.1 m-20 . . . . . 0 CA--C 1.514 -0.406 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 -179.57 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 62.2 t . . . . . 0 N--CA 1.463 0.213 0 CA-C-O 120.841 0.353 . . . . 0.0 110.63 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 46.5 m-85 -100.8 132.63 46.1 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.205 178.886 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 43.2 t -150.97 171.12 17.79 Favored 'General case' 0 C--O 1.231 0.093 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.197 -179.741 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . 41.7 mt -70.59 150.84 45.65 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.384 -179.576 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -53.85 -51.76 62.55 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.657 -0.417 . . . . 0.0 110.462 -179.63 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -138.87 -174.86 3.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.273 -179.372 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 68.2 p -92.6 7.99 40.96 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.451 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 212' ' ' HIS . . . . . . . . . . . . . 18.8 t-160 -51.11 -68.38 0.17 Allowed 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.039 0.447 . . . . 0.0 110.47 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 25.1 m -62.9 -32.87 57.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.295 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 214' ' ' ALA . . . . . . . . . . . . . . . -58.05 -50.37 73.68 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.594 -179.812 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -65.59 -43.17 90.54 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.212 179.827 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 216' ' ' LEU . . . . . 0.56 ' CD1' ' HB2' ' A' ' 101' ' ' ALA . 15.1 tp -60.24 -46.1 90.96 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.339 -179.526 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 79.3 mt -64.13 -38.55 91.46 Favored 'General case' 0 C--O 1.221 -0.406 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.332 179.373 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 63.9 t0 -59.45 -45.01 92.81 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.477 -179.879 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 219' ' ' GLU . . . . . 0.434 ' O ' ' CG ' ' B' ' 223' ' ' HIS . 15.8 mm-40 -64.23 -49.94 69.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.531 -179.921 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 220' ' ' ALA . . . . . 0.605 ' HB2' ' CD1' ' A' ' 97' ' ' LEU . . . -63.9 -40.97 97.73 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.328 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 221' ' ' ILE . . . . . 0.41 HG13 HH12 ' B' ' 162' ' ' ARG . 3.7 mm -63.45 -49.11 84.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 C-N-CA 120.639 -0.424 . . . . 0.0 110.764 -179.004 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -65.52 -44.56 86.55 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.836 0.351 . . . . 0.0 110.321 -179.799 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 223' ' ' HIS . . . . . 0.434 ' CG ' ' O ' ' B' ' 219' ' ' GLU . 62.3 m170 -61.81 -41.58 97.94 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.584 -179.485 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 5.5 t -75.07 -42.59 56.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.864 0.364 . . . . 0.0 111.153 179.932 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 80.0 tt0 -63.48 -26.86 68.91 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.462 -179.426 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 85.4 t60 . . . . . 0 C--N 1.331 -0.199 0 C-N-CA 120.721 -0.391 . . . . 0.0 110.054 -179.032 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.31 0 N-CA-C 109.494 -1.442 . . . . 0.0 109.494 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 23.5 m-70 -66.5 -39.03 88.49 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.784 0.326 . . . . 0.0 110.525 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 83.77 177.45 51.6 Favored Glycine 0 CA--C 1.523 0.552 0 N-CA-C 110.656 -0.978 . . . . 0.0 110.656 -179.79 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 27.1 m -135.66 161.97 37.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 120.742 0.306 . . . . 0.0 110.278 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -129.53 -19.17 3.44 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.465 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 61.61 -134.83 47.37 Favored Glycine 0 CA--C 1.524 0.61 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 89.9 mtm180 -74.31 144.44 44.52 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.701 0.286 . . . . 0.0 110.389 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 15.8 p30 -144.05 45.65 1.45 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.621 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.446 ' N ' ' CD ' ' A' ' 11' ' ' PRO . 82.3 mtt85 54.5 53.59 10.11 Favored Pre-proline 0 C--N 1.331 -0.2 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.514 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.446 ' CD ' ' N ' ' A' ' 10' ' ' ARG . 36.8 Cg_endo -65.66 137.66 50.91 Favored 'Trans proline' 0 C--N 1.308 -1.599 0 C-N-CA 122.747 2.298 . . . . 0.0 111.855 -179.557 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 38.1 t -173.49 171.93 3.8 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.675 179.739 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 49.2 68.8 3.16 Favored Pre-proline 0 CA--C 1.53 0.205 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.565 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -71.4 160.35 48.9 Favored 'Trans proline' 0 C--N 1.31 -1.463 0 C-N-CA 122.764 2.309 . . . . 0.0 111.927 -179.632 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 76.0 mt -69.04 165.45 20.18 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.24 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 38.1 m-20 -97.75 -51.49 4.08 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.36 0.6 . . . . 0.0 111.088 179.293 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 96.7 p -55.88 -28.39 56.39 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.254 -179.637 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 60.5 tp60 -70.91 -49.85 41.28 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.645 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.435 ' O ' HG23 ' A' ' 23' ' ' VAL . . . -55.34 -41.29 72.29 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 -179.741 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.8 -53.81 48.51 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 120.493 -0.483 . . . . 0.0 110.317 179.408 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.06 -47.73 80.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.9 0.381 . . . . 0.0 110.995 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 18.5 mm100 -56.58 -51.14 69.75 Favored 'General case' 0 C--O 1.24 0.604 0 CA-C-O 121.304 0.573 . . . . 0.0 110.488 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.435 HG23 ' O ' ' A' ' 19' ' ' ALA . 71.0 t -60.97 -43.12 95.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.814 179.674 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.485 ' HB2' HD12 ' B' ' 155' ' ' LEU . . . -50.83 -47.66 60.04 Favored 'General case' 0 C--O 1.223 -0.317 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.422 179.682 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 39.3 t -60.43 -43.15 97.08 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.084 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 21.7 m -63.34 -50.73 68.85 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.549 -0.46 . . . . 0.0 110.937 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 89.9 mt -70.13 -22.07 63.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.783 -179.487 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.488 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 55.3 tt0 -75.81 -55.1 5.96 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.661 178.946 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.48 -55.29 35.21 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 120.616 -0.434 . . . . 0.0 110.396 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.476 ' O ' ' O ' ' A' ' 31' ' ' ALA . 86.3 mt -45.99 -32.61 2.86 Favored 'General case' 0 CA--C 1.513 -0.447 0 C-N-CA 121.052 -0.259 . . . . 0.0 110.346 -179.202 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.488 ' HB3' ' O ' ' A' ' 28' ' ' GLN . . . -58.08 -126.84 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.282 179.575 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.512 ' HG1' ' HB3' ' A' ' 35' ' ' ARG . 0.6 OUTLIER 54.04 108.22 0.02 OUTLIER Pre-proline 0 CA--C 1.539 0.52 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.482 -179.721 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -48.77 -58.22 1.88 Allowed 'Trans proline' 0 N--CA 1.496 1.639 0 C-N-CA 122.265 1.977 . . . . 0.0 113.257 -179.752 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 5.4 t -57.26 -45.4 84.03 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.823 -178.803 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.512 ' HB3' ' HG1' ' A' ' 32' ' ' THR . 42.6 ttm180 -57.38 -44.05 84.12 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 120.806 -0.358 . . . . 0.0 110.778 -179.513 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.445 HD12 ' HB2' ' B' ' 143' ' ' ALA . 10.0 mt -62.64 -44.5 96.12 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.833 -0.347 . . . . 0.0 110.638 179.632 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 6.9 ttt -54.08 -48.77 70.31 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 120.371 -0.532 . . . . 0.0 110.222 179.844 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 47.8 mm -64.87 -43.03 96.37 Favored 'Isoleucine or valine' 0 C--O 1.236 0.39 0 CA-C-O 121.302 0.572 . . . . 0.0 110.528 179.387 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.614 ' O ' HD23 ' A' ' 39' ' ' LEU . 1.8 tt -61.6 -43.96 97.88 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.15 -179.308 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 12.0 m -59.26 -43.22 92.48 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.913 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 57.4 tp60 -55.56 -50.09 70.98 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.541 HD13 ' O ' ' A' ' 42' ' ' LEU . 0.2 OUTLIER -64.58 -42.92 95.3 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.96 0.886 . . . . 0.0 110.255 -179.498 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.51 ' O ' ' NE ' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -45.11 -35.79 3.31 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.389 -178.886 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 89.1 m-20 -61.29 -40.99 96.19 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.274 -179.779 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 167.1 170.9 32.55 Favored Glycine 0 CA--C 1.528 0.87 0 C-N-CA 120.549 -0.834 . . . . 0.0 111.25 178.782 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -62.6 150.49 87.59 Favored 'Trans proline' 0 N--CA 1.493 1.5 0 C-N-CA 122.733 2.289 . . . . 0.0 112.174 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 2.0 pp -175.14 145.03 0.85 Allowed Pre-proline 0 N--CA 1.449 -0.485 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.712 178.75 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -72.31 168.53 23.95 Favored 'Trans proline' 0 N--CA 1.498 1.742 0 C-N-CA 122.748 2.299 . . . . 0.0 112.28 178.846 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.5 HG23 ' N ' ' A' ' 50' ' ' THR . 9.0 m -63.26 -41.41 92.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.819 0.818 . . . . 0.0 110.603 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.5 ' N ' HG23 ' A' ' 49' ' ' VAL . 10.8 m -55.35 -41.01 71.95 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 114.756 -1.111 . . . . 0.0 110.479 179.538 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 89.2 m-20 -72.2 -42.92 65.26 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.086 0.47 . . . . 0.0 110.76 179.036 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.548 HD23 ' O ' ' A' ' 52' ' ' LEU . 1.1 tt -61.65 -36.14 79.94 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.088 -0.505 . . . . 0.0 109.91 -179.2 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.548 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -68.61 -48.51 63.92 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 116.175 -0.466 . . . . 0.0 109.854 179.818 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -53.15 -39.65 63.7 Favored 'General case' 0 C--O 1.232 0.166 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.392 179.529 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.47 -40.42 95.67 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.563 179.569 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 97.6 mt -89.89 -69.7 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.519 -0.227 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.362 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLY . . . . . 0.548 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 150.49 74.88 0.01 OUTLIER Glycine 0 CA--C 1.523 0.56 0 C-N-CA 120.869 -0.681 . . . . 0.0 111.677 179.421 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 34.2 ttm 61.27 77.01 0.35 Allowed 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.823 0.344 . . . . 0.0 110.968 179.036 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 88.1 mt-10 -150.29 21.57 0.84 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.694 179.653 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -60.44 -29.8 69.24 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.632 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 77.9 p -70.32 -45.91 65.27 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.641 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.415 ' O ' ' OE1' ' A' ' 66' ' ' GLN . . . -63.11 -32.06 73.35 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.926 179.79 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 77.1 t -69.18 -48.13 70.46 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.131 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.518 179.458 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 78.2 p -57.75 -41.88 82.82 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.642 -0.423 . . . . 0.0 110.424 -179.728 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' HIS . . . . . 0.432 ' O ' HG23 ' A' ' 69' ' ' VAL . 52.1 m80 -67.93 -43.67 78.61 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.945 179.606 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.485 ' N ' ' OE1' ' A' ' 66' ' ' GLN . 0.7 OUTLIER -59.48 -51.62 69.09 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.022 0.439 . . . . 0.0 110.389 -179.242 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -61.51 -40.11 93.42 Favored 'General case' 0 CA--C 1.505 -0.761 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.267 -179.612 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -57.61 -44.84 85.77 Favored 'General case' 0 C--N 1.307 -1.28 0 CA-C-O 121.417 0.627 . . . . 0.0 110.446 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.432 HG23 ' O ' ' A' ' 65' ' ' HIS . 90.3 t -62.29 -53.97 40.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 C-N-CA 120.248 -0.581 . . . . 0.0 110.012 -179.775 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.456 ' O ' ' O ' ' A' ' 74' ' ' GLY . 4.2 mm? -61.51 -31.74 71.76 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.093 0.473 . . . . 0.0 110.242 -179.791 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.715 HH12 ' H ' ' A' ' 78' ' ' GLY . 59.9 ttt85 -59.29 -41.83 89.86 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.262 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 99.2 m-20 -63.72 -37.43 87.33 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.159 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.445 HD23 ' N ' ' A' ' 73' ' ' LEU . 5.8 mt -89.42 -7.08 55.89 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.458 -179.487 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' GLY . . . . . 0.596 ' C ' ' H ' ' A' ' 76' ' ' VAL . . . 89.56 -140.92 15.87 Favored Glycine 0 CA--C 1.521 0.43 0 N-CA-C 110.357 -1.097 . . . . 0.0 110.357 -179.814 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 38.2 mt 67.29 -29.47 0.15 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.727 0.298 . . . . 0.0 110.528 -179.64 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.596 ' H ' ' C ' ' A' ' 74' ' ' GLY . 3.3 m -134.34 156.67 40.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.148 179.486 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 54.7 t -137.7 146.99 26.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.367 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.715 ' H ' HH12 ' A' ' 71' ' ' ARG . . . -121.47 140.92 14.25 Favored Glycine 0 C--N 1.335 0.514 0 N-CA-C 110.161 -1.176 . . . . 0.0 110.161 179.162 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 99.9 m-20 -114.37 106.43 14.3 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.9 0.381 . . . . 0.0 110.384 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 62.5 ttp180 -71.85 133.49 45.5 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.297 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -143.48 94.5 2.61 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.463 179.875 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 57.96 -118.63 13.64 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 110.921 -0.872 . . . . 0.0 110.921 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 17.5 ptp180 -99.04 29.67 3.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.793 0.33 . . . . 0.0 110.672 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 11.2 p -148.8 130.53 15.06 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.31 -179.89 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 1.1 tp -116.14 127.6 73.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 179.258 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 84.3 t -101.16 128.5 53.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.24 179.066 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.514 ' O ' HD21 ' A' ' 42' ' ' LEU . 80.7 m-85 -106.37 131.63 53.36 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.384 179.685 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 93.7 p -150.16 170.47 18.87 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-O 120.842 0.354 . . . . 0.0 110.191 -179.486 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.662 ' N ' HD22 ' A' ' 89' ' ' LEU . 3.5 mm? -72.31 148.02 45.79 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.537 -179.576 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 26.4 t80 -51.7 -47.46 63.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.187 -179.771 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.49 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 19.7 p-10 -153.49 179.19 9.03 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.703 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' THR . . . . . 0.467 ' O ' ' HB3' ' A' ' 95' ' ' ALA . 81.3 p -76.57 -17.91 58.95 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.609 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' HIS . . . . . 0.435 ' CD2' ' C ' ' A' ' 93' ' ' HIS . 12.1 t-160 -38.83 -69.39 0.13 Allowed 'General case' 0 C--O 1.236 0.368 0 CA-C-O 121.015 0.436 . . . . 0.0 110.777 -179.884 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 83.0 t -51.59 -41.16 27.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.969 -179.73 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.467 ' HB3' ' O ' ' A' ' 92' ' ' THR . . . -56.85 -47.82 79.5 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.666 -179.931 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 99.0 mm-40 -58.21 -47.81 82.33 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.122 -179.612 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.514 ' CD1' ' HB2' ' B' ' 220' ' ' ALA . 15.4 tp -59.38 -43.66 92.87 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.048 -179.577 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 87.1 mt -63.7 -40.37 96.62 Favored 'General case' 0 C--O 1.221 -0.427 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.433 179.812 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -59.02 -42.78 91.02 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.622 -179.486 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.516 ' O ' ' ND1' ' A' ' 104' ' ' HIS . 72.6 mm-40 -67.2 -48.69 67.13 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.786 -0.366 . . . . 0.0 110.764 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.605 ' HB2' ' CD1' ' B' ' 216' ' ' LEU . . . -64.88 -50.57 66.07 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.159 -179.623 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.534 ' O ' HD13 ' A' ' 102' ' ' ILE . 0.3 OUTLIER -62.36 -45.93 97.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 C-N-CA 120.396 -0.522 . . . . 0.0 110.769 -178.687 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 103' ' ' TYR . . . . . 0.52 ' N ' ' CG2' ' A' ' 102' ' ' ILE . 75.3 t80 -63.01 -49.31 75.14 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.117 -178.678 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' HIS . . . . . 0.516 ' ND1' ' O ' ' A' ' 100' ' ' GLU . 23.6 m80 -63.34 -37.22 86.41 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.737 -179.84 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 5.0 t -74.95 -44.07 50.58 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.946 0.403 . . . . 0.0 111.261 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 10.2 tm-20 -69.39 -21.59 63.77 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.566 -179.636 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' HIS . . . . . 0.472 ' CE1' HD21 ' A' ' 108' ' ' LEU . 0.3 OUTLIER -52.24 -70.31 0.09 Allowed 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.344 -179.091 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.472 HD21 ' CE1' ' A' ' 107' ' ' HIS . 52.7 mt -118.79 -136.21 0.34 Allowed 'General case' 0 N--CA 1.462 0.154 0 N-CA-C 109.9 -0.407 . . . . 0.0 109.9 -179.805 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' HIS . . . . . 0.515 ' NE2' ' O ' ' A' ' 111' ' ' GLY . 78.6 t60 -157.67 65.76 0.48 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.675 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 73.0 mt -63.69 -42.81 97.95 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.622 -179.884 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' GLY . . . . . 0.515 ' O ' ' NE2' ' A' ' 109' ' ' HIS . . . -84.78 142.05 19.84 Favored Glycine 0 CA--C 1.522 0.522 0 N-CA-C 110.581 -1.008 . . . . 0.0 110.581 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -140.48 150.86 44.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.72 0.295 . . . . 0.0 110.284 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 48.3 t -136.6 91.4 2.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.459 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -72.92 142.4 47.86 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.507 179.842 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 95.7 mtt-85 -57.12 105.9 0.27 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.376 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 5.6 m-70 -72.92 149.87 90.19 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.799 -179.455 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -68.44 155.09 70.34 Favored 'Trans proline' 0 N--CA 1.493 1.456 0 C-N-CA 122.624 2.216 . . . . 0.0 112.167 179.516 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 79.7 p -60.61 -34.23 73.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.267 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -62.86 -37.64 87.68 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.484 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.756 0 CA-C-O 117.982 -1.455 . . . . 0.0 110.874 179.949 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.278 0 N-CA-C 109.463 -1.455 . . . . 0.0 109.463 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 35.0 m-70 -66.25 -39.63 89.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.779 0.323 . . . . 0.0 110.476 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 123' ' ' GLY . . . . . . . . . . . . . . . 84.36 178.9 51.52 Favored Glycine 0 CA--C 1.524 0.632 0 N-CA-C 110.725 -0.95 . . . . 0.0 110.725 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 35.8 m -135.37 163.4 35.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.762 0.315 . . . . 0.0 110.232 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 125' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -130.6 -19.88 2.97 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.533 -179.907 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 63.97 -133.07 40.18 Favored Glycine 0 CA--C 1.524 0.636 0 N-CA-C 110.865 -0.894 . . . . 0.0 110.865 179.8 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 127' ' ' ARG . . . . . . . . . . . . . 89.5 mtm180 -77.01 145.45 38.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.705 0.288 . . . . 0.0 110.548 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 128' ' ' ASN . . . . . . . . . . . . . 14.8 p30 -144.05 47.56 1.42 Allowed 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.582 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 129' ' ' ARG . . . . . 0.438 ' N ' ' CD ' ' B' ' 130' ' ' PRO . 82.4 mtt85 51.03 54.63 15.55 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.418 179.843 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 130' ' ' PRO . . . . . 0.438 ' CD ' ' N ' ' B' ' 129' ' ' ARG . 38.4 Cg_endo -66.61 137.76 47.24 Favored 'Trans proline' 0 N--CA 1.495 1.587 0 C-N-CA 122.681 2.254 . . . . 0.0 111.893 -179.741 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 48.2 t -173.29 169.98 4.37 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.581 179.679 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 132' ' ' ALA . . . . . . . . . . . . . . . 50.65 68.73 3.12 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.524 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 133' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -71.6 160.69 47.59 Favored 'Trans proline' 0 C--N 1.312 -1.387 0 C-N-CA 122.791 2.327 . . . . 0.0 111.919 -179.48 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 69.2 mt -67.63 165.02 17.91 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.351 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 36.3 m-20 -97.91 -50.81 4.28 Favored 'General case' 0 C--O 1.238 0.47 0 CA-C-O 121.283 0.563 . . . . 0.0 110.991 179.256 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 92.1 p -57.21 -28.72 63.13 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.333 -179.584 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 10.3 tp-100 -70.66 -49.59 45.68 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.66 179.711 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 138' ' ' ALA . . . . . 0.444 ' O ' HG23 ' B' ' 142' ' ' VAL . . . -55.69 -40.28 72.14 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 120.705 -0.398 . . . . 0.0 109.93 -179.614 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -63.07 -53.41 54.05 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 120.547 -0.461 . . . . 0.0 110.237 179.21 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -57.24 -47.5 81.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.867 0.365 . . . . 0.0 110.86 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 88.0 mm-40 -55.99 -50.98 69.34 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-O 121.278 0.561 . . . . 0.0 110.452 -179.782 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 142' ' ' VAL . . . . . 0.444 HG23 ' O ' ' B' ' 138' ' ' ALA . 76.5 t -61.96 -42.95 96.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.864 179.734 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 143' ' ' ALA . . . . . 0.445 ' HB2' HD12 ' A' ' 36' ' ' LEU . . . -50.23 -48.6 54.4 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.269 179.561 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 38.1 t -60.42 -43.53 96.67 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.168 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 27.5 m -62.57 -50.48 71.13 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 120.556 -0.458 . . . . 0.0 111.026 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 91.3 mt -70.53 -21.6 62.71 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.901 -179.691 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 147' ' ' GLN . . . . . 0.469 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 58.3 tt0 -75.24 -56.98 4.18 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.561 179.144 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -59.65 -54.69 43.52 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.441 -179.454 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.487 ' O ' ' O ' ' B' ' 150' ' ' ALA . 81.0 mt -45.74 -34.5 3.65 Favored 'General case' 0 CA--C 1.514 -0.437 0 C-N-CA 120.976 -0.29 . . . . 0.0 110.455 -178.996 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 150' ' ' ALA . . . . . 0.487 ' O ' ' O ' ' B' ' 149' ' ' LEU . . . -57.57 -126.04 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.225 179.582 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 151' ' ' THR . . . . . 0.435 ' O ' ' O ' ' B' ' 150' ' ' ALA . 0.6 OUTLIER 54.35 108.22 0.02 OUTLIER Pre-proline 0 C--N 1.323 -0.579 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.49 -179.596 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_exo -48.26 -60.05 1.02 Allowed 'Trans proline' 0 N--CA 1.495 1.569 0 C-N-CA 122.256 1.97 . . . . 0.0 113.389 -179.769 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 39.8 t -56.64 -45.3 81.68 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.825 -178.736 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 154' ' ' ARG . . . . . 0.403 ' HB3' ' HG1' ' B' ' 151' ' ' THR . 42.0 ttm180 -57.17 -43.5 82.65 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 120.796 -0.362 . . . . 0.0 110.624 -179.583 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 155' ' ' LEU . . . . . 0.485 HD12 ' HB2' ' A' ' 24' ' ' ALA . 10.0 mt -63.1 -44.22 96.3 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.809 -0.357 . . . . 0.0 110.642 179.64 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 6.3 ttt -53.69 -48.76 69.22 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.358 -0.537 . . . . 0.0 110.158 179.739 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 41.8 mm -64.87 -43.43 96.33 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 CA-C-O 121.278 0.561 . . . . 0.0 110.524 179.431 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 158' ' ' LEU . . . . . 0.617 HD23 ' O ' ' B' ' 158' ' ' LEU . 1.7 tt -61.48 -43.5 98.76 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.064 -179.217 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 17.6 m -59.38 -43.51 92.88 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.033 -0.531 . . . . 0.0 109.996 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 61.3 tp60 -55.89 -49.97 71.93 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 120.483 -0.487 . . . . 0.0 109.811 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 161' ' ' LEU . . . . . 0.55 HD13 ' O ' ' B' ' 161' ' ' LEU . 0.2 OUTLIER -64.31 -41.83 96.63 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.733 0.778 . . . . 0.0 110.159 -179.454 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 162' ' ' ARG . . . . . 0.532 ' NE ' ' O ' ' B' ' 162' ' ' ARG . 0.0 OUTLIER -45.56 -36.4 4.63 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.261 -179.006 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -60.99 -41.64 96.89 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.214 -179.609 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . 167.61 171.85 34.05 Favored Glycine 0 CA--C 1.528 0.862 0 C-N-CA 120.582 -0.818 . . . . 0.0 111.341 178.817 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_exo -64.12 150.84 87.51 Favored 'Trans proline' 0 N--CA 1.494 1.508 0 C-N-CA 122.836 2.357 . . . . 0.0 112.215 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 1.8 pp -174.85 146.46 1.0 Allowed Pre-proline 0 C--N 1.326 -0.455 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.753 178.918 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -71.74 166.83 28.27 Favored 'Trans proline' 0 N--CA 1.495 1.614 0 C-N-CA 122.831 2.354 . . . . 0.0 112.316 178.874 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 168' ' ' VAL . . . . . 0.502 HG23 ' N ' ' B' ' 169' ' ' THR . 10.1 m -62.32 -40.9 89.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.83 0.824 . . . . 0.0 110.636 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 169' ' ' THR . . . . . 0.502 ' N ' HG23 ' B' ' 168' ' ' VAL . 7.4 m -56.83 -38.8 73.13 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 114.745 -1.116 . . . . 0.0 110.294 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 27.5 m-20 -71.7 -44.33 64.39 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.201 0.524 . . . . 0.0 110.335 179.346 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 171' ' ' LEU . . . . . 0.455 HD23 ' O ' ' B' ' 171' ' ' LEU . 0.7 OUTLIER -61.06 -32.54 72.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.16 -179.498 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 172' ' ' ALA . . . . . 0.541 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -70.99 -50.09 38.13 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.86 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -52.83 -38.82 61.86 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 120.515 -0.474 . . . . 0.0 110.336 179.607 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -64.76 -41.66 95.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.64 179.565 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 96.7 mt -89.4 -68.94 0.64 Allowed 'Isoleucine or valine' 0 CA--C 1.521 -0.139 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.329 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 176' ' ' GLY . . . . . 0.541 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 150.18 74.38 0.01 OUTLIER Glycine 0 CA--C 1.523 0.587 0 C-N-CA 120.959 -0.639 . . . . 0.0 111.633 179.373 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 33.4 ttm 61.38 78.15 0.3 Allowed 'General case' 0 C--O 1.232 0.148 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.866 179.293 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 88.2 mt-10 -150.56 23.09 0.8 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.628 179.77 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -61.78 -29.24 70.01 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.452 179.808 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 180' ' ' SER . . . . . 0.446 ' O ' ' ND1' ' B' ' 184' ' ' HIS . 78.3 p -70.28 -46.74 63.72 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.891 0.377 . . . . 0.0 110.463 -179.527 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 181' ' ' ALA . . . . . 0.409 ' O ' ' OE1' ' B' ' 185' ' ' GLN . . . -63.56 -30.97 72.01 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.931 179.691 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 54.2 t -69.34 -49.32 61.59 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.199 0 CA-C-O 121.135 0.493 . . . . 0.0 110.688 179.464 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 78.9 p -58.56 -40.61 83.53 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.653 -0.419 . . . . 0.0 110.463 -179.642 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 184' ' ' HIS . . . . . 0.446 ' ND1' ' O ' ' B' ' 180' ' ' SER . 51.4 m80 -67.92 -43.18 79.8 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.983 179.703 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 185' ' ' GLN . . . . . 0.476 ' N ' ' OE1' ' B' ' 185' ' ' GLN . 0.7 OUTLIER -60.49 -51.37 69.74 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.038 0.447 . . . . 0.0 110.491 -179.247 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -61.59 -39.65 91.97 Favored 'General case' 0 CA--C 1.506 -0.748 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.007 -179.572 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 15.1 tpt180 -57.91 -45.19 86.86 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-O 121.495 0.664 . . . . 0.0 110.46 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 73.9 t -62.21 -53.67 44.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 C-N-CA 120.159 -0.617 . . . . 0.0 109.96 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 189' ' ' LEU . . . . . 0.455 ' O ' ' O ' ' B' ' 193' ' ' GLY . 4.3 mm? -61.04 -31.88 71.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.09 0.472 . . . . 0.0 110.155 -179.751 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 190' ' ' ARG . . . . . 0.803 HH12 ' H ' ' B' ' 197' ' ' GLY . 60.4 ttt85 -59.61 -41.97 91.58 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.331 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 -63.57 -37.02 85.75 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 120.734 -0.386 . . . . 0.0 110.346 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 192' ' ' LEU . . . . . 0.454 ' N ' HD23 ' B' ' 192' ' ' LEU . 5.7 mt -89.56 -8.78 51.97 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.612 -179.364 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 193' ' ' GLY . . . . . 0.604 ' C ' ' H ' ' B' ' 195' ' ' VAL . . . 91.8 -141.72 15.75 Favored Glycine 0 CA--C 1.52 0.365 0 N-CA-C 110.389 -1.084 . . . . 0.0 110.389 -179.787 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 30.6 mt 67.86 -29.82 0.16 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.759 0.314 . . . . 0.0 110.613 -179.831 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 195' ' ' VAL . . . . . 0.604 ' H ' ' C ' ' B' ' 193' ' ' GLY . 3.1 m -136.18 158.34 38.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.29 179.735 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 196' ' ' VAL . . . . . . . . . . . . . 77.5 t -140.99 153.7 20.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.318 179.257 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 197' ' ' GLY . . . . . 0.803 ' H ' HH12 ' B' ' 190' ' ' ARG . . . -126.04 144.17 14.92 Favored Glycine 0 N--CA 1.464 0.505 0 N-CA-C 110.362 -1.095 . . . . 0.0 110.362 179.614 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 33.9 m-20 -114.48 109.16 17.87 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 120.89 0.376 . . . . 0.0 110.614 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 61.6 ttp180 -74.17 132.64 42.4 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.447 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 200' ' ' ALA . . . . . . . . . . . . . . . -142.24 95.44 2.8 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.689 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 201' ' ' GLY . . . . . . . . . . . . . . . 57.38 -115.48 6.72 Favored Glycine 0 CA--C 1.524 0.646 0 N-CA-C 110.712 -0.955 . . . . 0.0 110.712 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 202' ' ' ARG . . . . . . . . . . . . . 17.6 ptp180 -102.61 30.82 4.42 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.764 0.316 . . . . 0.0 110.592 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 10.2 p -148.44 130.68 15.54 Favored 'General case' 0 CA--C 1.516 -0.341 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.196 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 1.5 tp -116.65 125.65 73.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.76 179.674 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 96.6 t -100.11 129.09 51.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.151 179.267 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 206' ' ' TYR . . . . . 0.439 ' O ' HD21 ' B' ' 161' ' ' LEU . 85.7 m-85 -106.92 132.52 52.78 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.418 179.716 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 51.5 p -151.36 171.36 17.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.281 -179.625 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 208' ' ' LEU . . . . . 0.682 HD22 ' N ' ' B' ' 208' ' ' LEU . 3.5 mm? -73.62 148.52 42.78 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.814 -179.692 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 23.4 t80 -51.63 -47.81 63.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.271 -179.806 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 210' ' ' ASP . . . . . 0.518 ' N ' ' OD1' ' B' ' 210' ' ' ASP . 14.3 p-10 -153.07 -179.46 7.71 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.809 0.338 . . . . 0.0 110.655 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 211' ' ' THR . . . . . 0.466 ' O ' ' HB3' ' B' ' 214' ' ' ALA . 65.1 p -77.81 -16.94 57.97 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.531 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 212' ' ' HIS . . . . . 0.412 ' NE2' ' CB ' ' A' ' 104' ' ' HIS . 11.9 t-160 -39.4 -69.63 0.12 Allowed 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.079 0.466 . . . . 0.0 110.831 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 87.0 t -50.75 -41.56 21.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.924 -179.73 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 214' ' ' ALA . . . . . 0.466 ' HB3' ' O ' ' B' ' 211' ' ' THR . . . -57.34 -47.2 82.19 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.918 0.389 . . . . 0.0 110.813 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -57.98 -47.39 83.13 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.138 -179.538 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 216' ' ' LEU . . . . . 0.605 ' CD1' ' HB2' ' A' ' 101' ' ' ALA . 14.1 tp -60.62 -43.56 97.36 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 120.449 -0.501 . . . . 0.0 110.049 -179.64 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 86.6 mt -63.56 -39.94 95.68 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.439 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -59.66 -42.08 92.02 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.487 -179.566 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 219' ' ' GLU . . . . . 0.459 ' O ' ' ND1' ' B' ' 223' ' ' HIS . 70.8 mm-40 -67.72 -49.2 63.86 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.796 -0.361 . . . . 0.0 110.742 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 220' ' ' ALA . . . . . 0.514 ' HB2' ' CD1' ' A' ' 97' ' ' LEU . . . -63.89 -51.3 65.16 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.986 -179.667 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 221' ' ' ILE . . . . . 0.553 HD13 ' O ' ' B' ' 221' ' ' ILE . 0.2 OUTLIER -62.26 -45.91 97.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 C-N-CA 120.419 -0.512 . . . . 0.0 110.667 -178.587 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 222' ' ' TYR . . . . . 0.508 ' N ' ' CG2' ' B' ' 221' ' ' ILE . 77.1 t80 -62.52 -49.29 75.95 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.06 -178.489 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 223' ' ' HIS . . . . . 0.459 ' ND1' ' O ' ' B' ' 219' ' ' GLU . 23.8 m80 -63.76 -36.54 84.21 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.737 -179.849 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 5.6 t -75.04 -44.66 46.5 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.927 0.394 . . . . 0.0 111.354 179.792 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 11.5 tm-20 -69.58 -21.67 63.59 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.596 -179.598 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 226' ' ' HIS . . . . . 0.406 ' CE1' HD21 ' B' ' 227' ' ' LEU . 0.4 OUTLIER -52.03 -70.17 0.09 Allowed 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 120.581 -0.448 . . . . 0.0 110.458 -179.145 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 227' ' ' LEU . . . . . 0.406 HD21 ' CE1' ' B' ' 226' ' ' HIS . 52.9 mt -118.5 -134.08 0.33 Allowed 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 228' ' ' HIS . . . . . 0.508 ' NE2' ' O ' ' B' ' 230' ' ' GLY . 77.5 t60 -160.39 65.05 0.33 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.619 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 229' ' ' LEU . . . . . . . . . . . . . 73.1 mt -63.4 -42.19 98.77 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.765 -179.907 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 230' ' ' GLY . . . . . 0.508 ' O ' ' NE2' ' B' ' 228' ' ' HIS . . . -84.93 140.42 18.59 Favored Glycine 0 CA--C 1.523 0.555 0 N-CA-C 110.674 -0.97 . . . . 0.0 110.674 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 231' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -137.16 153.08 50.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.739 0.304 . . . . 0.0 110.246 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 232' ' ' SER . . . . . . . . . . . . . 45.6 t -139.11 89.16 2.33 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.582 -179.847 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 233' ' ' ASP . . . . . . . . . . . . . 97.1 m-20 -71.67 144.6 49.31 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.365 179.788 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 234' ' ' ARG . . . . . . . . . . . . . 95.7 mtt-85 -59.88 104.58 0.31 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.586 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 235' ' ' HIS . . . . . . . . . . . . . 4.5 m-70 -70.81 149.42 95.11 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.786 -179.394 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 236' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -67.99 154.4 72.82 Favored 'Trans proline' 0 N--CA 1.494 1.504 0 C-N-CA 122.619 2.213 . . . . 0.0 112.142 179.681 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 237' ' ' SER . . . . . . . . . . . . . 78.3 p -59.67 -34.18 72.52 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.271 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 238' ' ' ALA . . . . . . . . . . . . . . . -63.56 -38.48 91.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.617 179.873 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.726 0 CA-C-O 118.09 -1.394 . . . . 0.0 110.914 -179.958 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.297 0 N-CA-C 109.387 -1.485 . . . . 0.0 109.387 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 -130.3 141.2 50.61 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.856 0.36 . . . . 0.0 110.511 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 79.88 18.6 72.24 Favored Glycine 0 CA--C 1.521 0.411 0 N-CA-C 111.01 -0.836 . . . . 0.0 111.01 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.449 HG22 ' H ' ' A' ' 7' ' ' GLY . 11.8 p -125.87 135.14 64.81 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 CA-C-O 120.897 0.38 . . . . 0.0 110.545 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -63.73 -39.31 93.97 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.466 -179.832 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLY . . . . . 0.449 ' H ' HG22 ' A' ' 5' ' ' VAL . . . 131.71 95.65 0.66 Allowed Glycine 0 N--CA 1.465 0.6 0 N-CA-C 110.797 -0.921 . . . . 0.0 110.797 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 85.1 mtt85 48.65 80.83 0.06 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.823 0.344 . . . . 0.0 110.496 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 85.7 m-20 -72.63 140.09 47.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.515 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 58.4 ttm-85 46.24 75.81 0.62 Allowed Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.537 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -58.17 141.76 96.77 Favored 'Trans proline' 0 C--N 1.305 -1.743 0 C-N-CA 122.639 2.226 . . . . 0.0 112.055 -179.817 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.8 p -82.08 172.27 13.41 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.663 179.643 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.615 ' H ' ' CD ' ' A' ' 14' ' ' PRO . . . -173.45 -44.77 0.0 OUTLIER Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.418 179.888 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.615 ' CD ' ' H ' ' A' ' 13' ' ' ALA . 39.3 Cg_exo -61.06 135.9 61.86 Favored 'Trans proline' 0 C--N 1.309 -1.542 0 C-N-CA 122.659 2.239 . . . . 0.0 111.735 -179.41 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.515 ' N ' HD23 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -102.19 -56.29 2.29 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.221 -179.628 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.46 ' C ' ' O ' ' A' ' 15' ' ' LEU . 9.0 m-20 -32.34 -56.69 0.33 Allowed 'General case' 0 C--O 1.234 0.245 0 O-C-N 123.359 0.412 . . . . 0.0 110.927 -178.998 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 11.9 t -58.22 -50.01 75.08 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.818 179.439 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.562 ' NE2' ' O ' ' A' ' 14' ' ' PRO . 75.4 mt-30 -61.41 -43.13 99.4 Favored 'General case' 0 C--O 1.221 -0.407 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.393 179.787 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -55.3 -41.33 72.2 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.296 -179.714 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.05 -54.8 21.29 Favored 'General case' 0 C--N 1.333 -0.126 0 C-N-CA 120.672 -0.411 . . . . 0.0 110.835 179.752 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -58.58 -50.52 73.51 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.933 179.515 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.415 ' OE1' ' OG ' ' B' ' 224' ' ' SER . 54.5 tt0 -53.63 -50.69 65.15 Favored 'General case' 0 C--O 1.244 0.767 0 CA-C-O 121.061 0.458 . . . . 0.0 110.502 -179.766 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.432 ' O ' ' OG1' ' A' ' 26' ' ' THR . 49.1 t -61.5 -43.62 97.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.071 -0.513 . . . . 0.0 109.818 179.271 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.417 ' HB2' HD12 ' B' ' 155' ' ' LEU . . . -53.49 -47.24 70.0 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.308 -179.842 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 41.1 t -58.71 -43.66 90.17 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.508 -179.275 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.432 ' OG1' ' O ' ' A' ' 23' ' ' VAL . 12.7 p -65.45 -53.81 37.47 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 120.602 -0.439 . . . . 0.0 111.216 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.433 ' N ' ' CD1' ' A' ' 27' ' ' LEU . 8.0 mp -65.44 -23.13 66.86 Favored 'General case' 0 C--O 1.222 -0.39 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.941 -179.945 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.474 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 46.6 tt0 -73.11 -63.8 1.1 Allowed 'General case' 0 C--N 1.32 -0.682 0 O-C-N 123.39 0.431 . . . . 0.0 110.588 -179.817 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -54.94 -52.45 62.94 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.905 -179.111 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.405 ' O ' ' C ' ' A' ' 31' ' ' ALA . 4.1 mm? -53.44 -40.0 64.84 Favored 'General case' 0 CA--C 1.512 -0.516 0 C-N-CA 120.701 -0.399 . . . . 0.0 110.917 -179.636 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.587 ' O ' ' C ' ' A' ' 32' ' ' THR . . . -38.76 -73.1 0.05 Allowed 'General case' 0 CA--C 1.51 -0.59 0 O-C-N 123.637 0.585 . . . . 0.0 110.309 179.916 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.587 ' C ' ' O ' ' A' ' 31' ' ' ALA . 6.0 p -4.53 110.99 0.03 OUTLIER Pre-proline 0 CA--C 1.54 0.56 0 O-C-N 124.294 0.996 . . . . 0.0 111.134 179.241 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_exo -50.11 -45.52 32.81 Favored 'Trans proline' 0 C--N 1.303 -1.843 0 C-N-CA 122.231 1.954 . . . . 0.0 112.45 -177.682 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 66.7 m -56.98 -44.82 83.05 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.982 -179.105 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 77.6 mmt-85 -63.31 -38.32 90.7 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.063 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.424 ' CD1' ' O ' ' A' ' 31' ' ' ALA . 93.9 mt -64.66 -54.2 35.49 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.682 -0.407 . . . . 0.0 111.14 -179.614 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 10.7 tpt -54.34 -49.44 69.73 Favored 'General case' 0 C--O 1.239 0.539 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.394 -179.847 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 5.3 mm -62.77 -44.19 99.32 Favored 'Isoleucine or valine' 0 C--O 1.243 0.742 0 CA-C-O 121.22 0.533 . . . . 0.0 110.832 179.619 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 27.1 mt -61.41 -39.23 89.97 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.165 179.602 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 18.9 m -58.83 -40.37 83.99 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 179.554 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -60.55 -44.54 96.03 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 121.072 0.463 . . . . 0.0 110.077 179.827 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.511 HD21 HD13 ' A' ' 47' ' ' LEU . 13.8 mt -63.45 -37.94 89.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.746 179.158 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.425 ' C ' ' O ' ' A' ' 42' ' ' LEU . 77.4 ttt-85 -35.76 -30.04 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.482 -178.952 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.497 ' N ' ' O ' ' A' ' 42' ' ' LEU . 98.8 m-20 -65.34 -48.69 72.13 Favored 'General case' 0 C--N 1.334 -0.092 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.803 179.476 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.493 ' N ' ' O ' ' A' ' 42' ' ' LEU . . . 152.45 -79.52 0.2 Allowed Glycine 0 CA--C 1.528 0.863 0 N-CA-C 110.717 -0.953 . . . . 0.0 110.717 179.827 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -70.21 -172.88 0.67 Allowed 'Trans proline' 0 C--N 1.306 -1.692 0 C-N-CA 122.699 2.266 . . . . 0.0 111.937 179.513 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.511 HD13 HD21 ' A' ' 42' ' ' LEU . 6.8 tp -140.24 70.14 33.82 Favored Pre-proline 0 N--CA 1.454 -0.249 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.21 179.061 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_exo -62.42 91.73 0.13 Allowed 'Trans proline' 0 C--N 1.303 -1.839 0 C-N-CA 122.816 2.344 . . . . 0.0 110.973 177.442 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 55.0 t -55.91 -53.18 41.06 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 C-N-CA 120.639 -0.424 . . . . 0.0 111.62 -179.019 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.476 ' O ' ' OE1' ' A' ' 54' ' ' GLU . 29.0 p -63.07 -63.32 1.23 Allowed 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 120.894 0.378 . . . . 0.0 110.917 179.937 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.436 ' N ' ' OG1' ' A' ' 50' ' ' THR . 0.3 OUTLIER -46.14 -47.13 17.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.325 -178.723 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 68.1 mt -62.71 -38.62 91.16 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.582 179.184 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.431 ' HB3' ' O ' ' A' ' 50' ' ' THR . . . -54.13 -50.98 65.69 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.494 179.716 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.476 ' OE1' ' O ' ' A' ' 50' ' ' THR . 7.7 mp0 -63.77 -38.44 91.11 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.357 179.78 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 0.445 ' O ' HG23 ' A' ' 56' ' ' ILE . . . -57.21 -61.37 2.51 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 120.365 -0.534 . . . . 0.0 111.326 -179.125 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.445 HG23 ' O ' ' A' ' 55' ' ' ALA . 15.0 pt -156.89 -10.28 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.731 -179.772 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -61.23 -55.43 29.39 Favored Glycine 0 C--N 1.335 0.526 0 N-CA-C 110.924 -0.87 . . . . 0.0 110.924 -178.727 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 78.9 mtp 45.55 25.82 0.27 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.684 0.278 . . . . 0.0 110.475 179.341 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.531 ' HG2' ' H ' ' A' ' 62' ' ' ALA . 73.2 tt0 -171.73 84.5 0.08 Allowed 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 109.77 -0.455 . . . . 0.0 109.77 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -63.7 -30.38 71.49 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.249 -179.204 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 35.5 t -64.14 -36.3 83.59 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.503 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.531 ' H ' ' HG2' ' A' ' 59' ' ' GLU . . . -67.71 -33.59 75.2 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.657 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 73.6 t -73.06 -52.84 20.42 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.919 -179.603 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 77.4 p -58.7 -44.58 90.38 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.316 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -62.78 -50.42 71.11 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.545 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 32.5 tt0 -60.9 -39.71 90.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.395 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 48.8 tp -61.12 -43.42 98.9 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.331 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -61.51 -40.59 95.17 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.403 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 97.9 t -61.7 -54.67 31.69 Favored 'Isoleucine or valine' 0 N--CA 1.46 0.069 0 C-N-CA 120.208 -0.597 . . . . 0.0 110.398 -179.479 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 10.9 mp -61.84 -33.79 74.79 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 179.612 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 26.2 tpt85 -58.4 -41.91 85.98 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.356 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 99.8 m-20 -60.72 -44.15 96.97 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.238 -179.481 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.407 ' HG ' ' H ' ' A' ' 73' ' ' LEU . 10.3 mt -63.87 -40.16 95.89 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.223 -179.801 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 103.94 19.27 12.07 Favored Glycine 0 CA--C 1.522 0.529 0 N-CA-C 110.869 -0.893 . . . . 0.0 110.869 -179.772 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.3 tp -80.54 -6.01 57.59 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.034 0.445 . . . . 0.0 110.694 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 34.6 m -139.27 163.26 26.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.298 -179.858 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.591 HG12 ' N ' ' A' ' 78' ' ' GLY . 77.7 t -149.49 164.43 3.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.789 179.867 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.591 ' N ' HG12 ' A' ' 77' ' ' VAL . . . -107.65 147.05 16.32 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 110.445 -1.062 . . . . 0.0 110.445 179.374 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -130.67 137.54 49.62 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 120.762 0.315 . . . . 0.0 110.771 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.416 ' CD ' ' N ' ' A' ' 80' ' ' ARG . 1.1 mpt_? -74.66 131.81 41.2 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.215 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.487 ' O ' ' N ' ' A' ' 83' ' ' ARG . . . -135.59 91.62 2.74 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.186 179.063 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.451 ' C ' ' O ' ' A' ' 81' ' ' ALA . . . 29.8 -91.38 0.01 OUTLIER Glycine 0 C--N 1.338 0.679 0 N-CA-C 111.872 -0.491 . . . . 0.0 111.872 179.307 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.487 ' N ' ' O ' ' A' ' 81' ' ' ALA . 85.2 mtp180 -41.99 -63.9 0.67 Allowed 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.948 -0.301 . . . . 0.0 111.311 179.762 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 67.9 m -155.84 179.93 8.74 Favored 'General case' 0 C--O 1.221 -0.408 0 CA-C-O 121.062 0.458 . . . . 0.0 110.459 -178.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.576 ' C ' HD12 ' A' ' 85' ' ' ILE . 1.1 pp -88.71 152.8 3.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.072 -179.62 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.501 ' N ' HD12 ' A' ' 85' ' ' ILE . 29.3 m -128.77 161.44 37.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.605 179.561 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 78.4 m-85 -98.09 131.99 44.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.3 -179.429 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 66.0 p -145.49 166.74 24.8 Favored 'General case' 0 C--O 1.224 -0.243 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.142 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 44.8 mt -65.79 145.0 56.51 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.556 -179.607 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 12.7 t80 -50.47 -47.09 57.19 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.403 -179.511 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 23.6 p30 -141.69 169.73 17.04 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.861 0.362 . . . . 0.0 110.454 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' THR . . . . . 0.514 ' O ' ' HB3' ' A' ' 95' ' ' ALA . 0.0 OUTLIER -85.71 -16.88 37.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.476 -179.756 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 -45.43 -65.02 0.6 Allowed 'General case' 0 C--O 1.237 0.429 0 CA-C-O 120.984 0.421 . . . . 0.0 110.589 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.419 HG13 ' N ' ' A' ' 95' ' ' ALA . 12.5 p -48.0 -36.63 5.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.303 -179.821 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.514 ' HB3' ' O ' ' A' ' 92' ' ' THR . . . -64.35 -37.64 88.24 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.241 179.452 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 66.5 tp60 -62.51 -47.28 84.65 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-O 121.275 0.56 . . . . 0.0 109.935 -179.595 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.61 HD21 ' HA ' ' B' ' 220' ' ' ALA . 7.1 mp -61.56 -42.75 99.3 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 120.424 -0.511 . . . . 0.0 110.214 -179.473 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 93.8 mt -66.97 -35.25 79.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.267 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 36.3 m-20 -60.78 -42.39 97.43 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.29 -0.413 . . . . 0.0 109.993 -179.408 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.497 ' C ' ' HD1' ' A' ' 104' ' ' HIS . 82.7 mt-10 -70.43 -52.81 19.56 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.383 179.197 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.594 ' HA ' HD21 ' B' ' 216' ' ' LEU . . . -55.44 -45.81 76.79 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.627 179.563 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 5.1 mm -63.57 -44.92 98.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.87 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 89.6 t80 -63.96 -47.02 82.09 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.145 0.497 . . . . 0.0 110.61 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' HIS . . . . . 0.497 ' HD1' ' C ' ' A' ' 100' ' ' GLU . 51.8 m80 -60.62 -36.09 77.76 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.472 -179.735 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.421 ' OG ' ' OE1' ' B' ' 141' ' ' GLN . 38.9 t -76.52 -46.88 24.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.873 179.562 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -55.59 -28.21 53.77 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.359 -179.635 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 52.8 t-80 -79.57 -2.56 42.99 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.685 179.708 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 57.1 tp -154.43 104.81 2.6 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.446 179.816 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -173.7 43.47 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.586 179.523 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.556 ' N ' HD12 ' A' ' 110' ' ' LEU . 10.4 mp -62.64 -42.18 99.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.314 -179.646 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 146.38 95.72 0.18 Allowed Glycine 0 N--CA 1.461 0.333 0 N-CA-C 110.88 -0.888 . . . . 0.0 110.88 -179.835 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 49.5 tp -129.95 129.97 44.48 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.831 0.348 . . . . 0.0 110.634 179.719 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 11.7 t -60.63 -43.89 96.99 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.61 179.556 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' ASP . . . . . 0.434 ' O ' ' N ' ' A' ' 116' ' ' HIS . 52.3 t0 44.6 72.06 0.22 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.562 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 10.1 tpp85 -56.01 88.01 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.586 -179.701 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' HIS . . . . . 0.627 ' N ' ' CD ' ' A' ' 117' ' ' PRO . 0.1 OUTLIER -94.34 -42.79 0.3 Allowed Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.38 179.409 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 117' ' ' PRO . . . . . 0.627 ' CD ' ' N ' ' A' ' 116' ' ' HIS . 23.6 Cg_exo -63.49 146.44 92.98 Favored 'Trans proline' 0 C--N 1.304 -1.81 0 C-N-CA 122.643 2.229 . . . . 0.0 111.726 -179.719 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 8.5 m -145.2 -30.09 0.43 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.558 179.383 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -70.61 144.6 51.12 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.613 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.686 0 CA-C-O 117.967 -1.463 . . . . 0.0 110.877 -179.925 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.223 0 N-CA-C 109.363 -1.495 . . . . 0.0 109.363 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 -128.04 143.19 51.06 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 120.976 0.417 . . . . 0.0 110.459 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 123' ' ' GLY . . . . . . . . . . . . . . . 78.55 19.61 73.34 Favored Glycine 0 CA--C 1.52 0.38 0 N-CA-C 110.995 -0.842 . . . . 0.0 110.995 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 124' ' ' VAL . . . . . 0.408 HG22 ' H ' ' B' ' 126' ' ' GLY . 14.7 p -126.99 135.32 63.99 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 CA-C-O 120.897 0.379 . . . . 0.0 110.47 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 125' ' ' GLU . . . . . . . . . . . . . 72.2 mm-40 -63.69 -40.37 96.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.458 -179.896 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 126' ' ' GLY . . . . . 0.408 ' H ' HG22 ' B' ' 124' ' ' VAL . . . 132.35 94.2 0.58 Allowed Glycine 0 N--CA 1.464 0.551 0 N-CA-C 110.91 -0.876 . . . . 0.0 110.91 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 127' ' ' ARG . . . . . . . . . . . . . 85.4 mtt85 50.17 80.42 0.07 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.864 0.364 . . . . 0.0 110.592 179.782 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 128' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -72.8 140.87 47.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.439 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 129' ' ' ARG . . . . . . . . . . . . . 57.8 ttm-85 44.7 75.05 0.69 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.084 0.469 . . . . 0.0 110.499 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -59.26 145.3 98.23 Favored 'Trans proline' 0 C--N 1.305 -1.746 0 C-N-CA 122.68 2.253 . . . . 0.0 112.11 -179.792 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 13.2 p -81.53 176.21 9.87 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.478 179.603 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 132' ' ' ALA . . . . . 0.594 ' H ' ' HD2' ' B' ' 133' ' ' PRO . . . -176.18 -44.83 0.0 OUTLIER Pre-proline 0 C--N 1.325 -0.479 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.615 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 133' ' ' PRO . . . . . 0.594 ' HD2' ' H ' ' B' ' 132' ' ' ALA . 31.8 Cg_exo -58.42 140.71 95.65 Favored 'Trans proline' 0 C--N 1.308 -1.601 0 C-N-CA 122.593 2.195 . . . . 0.0 111.747 -178.732 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -116.39 10.57 14.72 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.347 179.875 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -95.44 -59.56 1.85 Allowed 'General case' 0 C--O 1.238 0.476 0 CA-C-O 121.279 0.561 . . . . 0.0 110.591 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 11.4 t -59.26 -41.35 88.59 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.248 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -64.86 -46.28 82.51 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.44 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 138' ' ' ALA . . . . . . . . . . . . . . . -54.5 -41.56 69.75 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.183 -179.665 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -66.14 -54.3 27.17 Favored 'General case' 0 N--CA 1.457 -0.112 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.897 179.476 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -58.38 -51.27 70.54 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.976 179.594 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 141' ' ' GLN . . . . . 0.421 ' OE1' ' OG ' ' A' ' 105' ' ' SER . 57.1 tt0 -53.43 -49.86 66.44 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-O 121.084 0.469 . . . . 0.0 110.385 -179.747 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 142' ' ' VAL . . . . . . . . . . . . . 51.2 t -61.66 -43.25 96.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.699 179.186 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -54.44 -46.52 73.28 Favored 'General case' 0 C--O 1.217 -0.62 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.307 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 40.0 t -59.01 -44.01 91.64 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.508 -179.256 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 18.0 p -65.51 -53.8 37.26 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 120.619 -0.432 . . . . 0.0 111.216 179.875 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 146' ' ' LEU . . . . . 0.415 ' N ' ' CD1' ' B' ' 146' ' ' LEU . 8.2 mp -65.04 -23.11 67.09 Favored 'General case' 0 C--O 1.22 -0.453 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.016 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 147' ' ' GLN . . . . . 0.485 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 46.5 tt0 -73.66 -63.35 1.22 Allowed 'General case' 0 C--N 1.319 -0.741 0 O-C-N 123.364 0.415 . . . . 0.0 110.498 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -55.19 -52.92 61.8 Favored 'General case' 0 CA--C 1.521 -0.153 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.01 -179.085 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.411 ' O ' ' C ' ' B' ' 150' ' ' ALA . 4.1 mm? -52.96 -39.87 63.27 Favored 'General case' 0 CA--C 1.514 -0.429 0 C-N-CA 120.661 -0.415 . . . . 0.0 110.943 -179.773 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 150' ' ' ALA . . . . . 0.58 ' O ' ' C ' ' B' ' 151' ' ' THR . . . -39.19 -72.87 0.05 Allowed 'General case' 0 CA--C 1.511 -0.557 0 O-C-N 123.649 0.593 . . . . 0.0 110.285 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 151' ' ' THR . . . . . 0.58 ' C ' ' O ' ' B' ' 150' ' ' ALA . 6.8 p -4.77 110.3 0.03 OUTLIER Pre-proline 0 CA--C 1.54 0.582 0 O-C-N 124.279 0.987 . . . . 0.0 111.097 179.292 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_exo -49.4 -45.08 32.05 Favored 'Trans proline' 0 C--N 1.302 -1.875 0 C-N-CA 122.192 1.928 . . . . 0.0 112.487 -177.569 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 53.5 m -57.3 -44.85 84.45 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.983 -179.128 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 154' ' ' ARG . . . . . 0.621 ' NH1' HE21 ' B' ' 185' ' ' GLN . 77.2 mmt-85 -63.16 -39.01 93.42 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.996 -179.704 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 155' ' ' LEU . . . . . 0.417 HD12 ' HB2' ' A' ' 24' ' ' ALA . 94.4 mt -63.86 -54.41 35.27 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 120.733 -0.387 . . . . 0.0 111.102 -179.559 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 10.8 tpt -54.48 -49.65 69.61 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.489 -0.484 . . . . 0.0 110.461 -179.755 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 5.0 mm -62.21 -44.36 99.01 Favored 'Isoleucine or valine' 0 C--O 1.242 0.686 0 CA-C-O 121.328 0.585 . . . . 0.0 110.764 179.643 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 27.5 mt -61.81 -39.32 91.33 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.109 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 99.8 m -58.5 -40.64 83.39 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 179.662 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -60.73 -44.24 96.9 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 120.968 0.414 . . . . 0.0 109.927 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 161' ' ' LEU . . . . . 0.534 HD21 HD13 ' B' ' 166' ' ' LEU . 14.2 mt -63.72 -36.31 83.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.852 179.219 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 162' ' ' ARG . . . . . 0.421 ' C ' ' O ' ' B' ' 161' ' ' LEU . 77.4 ttt-85 -36.48 -30.63 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.471 -179.104 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 163' ' ' ASN . . . . . 0.476 ' N ' ' O ' ' B' ' 161' ' ' LEU . 96.4 m-20 -64.96 -50.25 67.15 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.834 179.81 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 164' ' ' GLY . . . . . 0.449 ' N ' ' O ' ' B' ' 161' ' ' LEU . . . 153.91 -78.01 0.2 Allowed Glycine 0 CA--C 1.528 0.891 0 N-CA-C 110.682 -0.967 . . . . 0.0 110.682 179.715 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -70.71 -171.43 0.55 Allowed 'Trans proline' 0 C--N 1.306 -1.709 0 C-N-CA 122.681 2.254 . . . . 0.0 111.96 179.793 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 166' ' ' LEU . . . . . 0.534 HD13 HD21 ' B' ' 161' ' ' LEU . 8.7 tp -142.25 69.9 22.34 Favored Pre-proline 0 C--N 1.331 -0.217 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.084 179.208 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_exo -63.02 91.83 0.14 Allowed 'Trans proline' 0 C--N 1.303 -1.863 0 C-N-CA 122.903 2.402 . . . . 0.0 111.123 177.774 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . 71.0 t -55.47 -53.29 37.62 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 C-N-CA 120.629 -0.429 . . . . 0.0 111.788 -178.863 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 169' ' ' THR . . . . . 0.476 ' O ' ' OE1' ' B' ' 173' ' ' GLU . 23.5 p -63.01 -63.1 1.3 Allowed 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.16 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 170' ' ' ASP . . . . . 0.442 ' N ' ' OG1' ' B' ' 169' ' ' THR . 0.8 OUTLIER -48.02 -44.97 31.44 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.159 -0.473 . . . . 0.0 109.966 -177.96 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 64.5 mt -63.52 -39.79 95.36 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.681 178.643 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 172' ' ' ALA . . . . . 0.409 ' HB3' ' O ' ' B' ' 169' ' ' THR . . . -53.31 -50.57 64.66 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.355 179.557 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 173' ' ' GLU . . . . . 0.476 ' OE1' ' O ' ' B' ' 169' ' ' THR . 8.7 mp0 -63.51 -38.86 92.77 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.382 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 174' ' ' ALA . . . . . 0.452 ' O ' HG23 ' B' ' 175' ' ' ILE . . . -56.76 -61.86 2.14 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 120.364 -0.534 . . . . 0.0 111.23 -179.077 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 175' ' ' ILE . . . . . 0.452 HG23 ' O ' ' B' ' 174' ' ' ALA . 15.5 pt -156.63 -9.76 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.752 -179.786 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . -61.51 -55.12 30.7 Favored Glycine 0 CA--C 1.521 0.467 0 N-CA-C 110.94 -0.864 . . . . 0.0 110.94 -178.755 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 76.5 mtp 45.43 26.37 0.29 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.706 0.288 . . . . 0.0 110.402 179.193 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 178' ' ' GLU . . . . . 0.471 ' HG2' ' H ' ' B' ' 181' ' ' ALA . 70.2 tt0 -172.6 85.34 0.06 Allowed 'General case' 0 CA--C 1.528 0.103 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -179.91 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -64.21 -29.84 70.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.289 -179.252 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 38.4 t -64.07 -37.74 88.54 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.534 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 181' ' ' ALA . . . . . 0.471 ' H ' ' HG2' ' B' ' 178' ' ' GLU . . . -66.71 -33.27 75.26 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.683 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 74.8 t -73.36 -53.05 19.22 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.15 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.866 -179.693 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 78.0 p -59.34 -44.03 92.7 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 -179.777 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 58.9 t-80 -63.9 -50.38 68.97 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-O 120.935 0.398 . . . . 0.0 110.653 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 185' ' ' GLN . . . . . 0.621 HE21 ' NH1' ' B' ' 154' ' ' ARG . 40.4 tt0 -61.27 -39.83 91.85 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.106 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 53.6 tp -60.92 -45.14 95.84 Favored 'General case' 0 C--O 1.222 -0.372 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.305 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -59.79 -41.66 91.67 Favored 'General case' 0 C--O 1.241 0.646 0 O-C-N 123.212 0.32 . . . . 0.0 110.415 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 88.1 t -59.26 -54.05 39.64 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.096 0 C-N-CA 120.241 -0.583 . . . . 0.0 110.076 -179.357 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 10.8 mp -62.13 -33.05 73.76 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.927 -0.398 . . . . 0.0 109.927 179.503 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -57.76 -41.41 81.88 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.26 -179.411 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -63.1 -40.48 97.77 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.425 -179.58 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 192' ' ' LEU . . . . . 0.412 ' N ' HD23 ' B' ' 192' ' ' LEU . 9.1 mt -66.27 -40.12 89.9 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.469 -179.489 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 103.44 17.13 18.41 Favored Glycine 0 CA--C 1.523 0.561 0 N-CA-C 110.923 -0.871 . . . . 0.0 110.923 -179.587 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 4.5 tp -80.24 -6.16 57.4 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.965 0.412 . . . . 0.0 110.656 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 34.3 m -138.67 162.5 29.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.33 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 196' ' ' VAL . . . . . 0.607 HG12 ' N ' ' B' ' 197' ' ' GLY . 71.3 t -149.28 164.16 4.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 120.905 0.384 . . . . 0.0 110.787 179.777 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 197' ' ' GLY . . . . . 0.607 ' N ' HG12 ' B' ' 196' ' ' VAL . . . -106.92 147.47 16.22 Favored Glycine 0 CA--C 1.523 0.575 0 N-CA-C 110.428 -1.069 . . . . 0.0 110.428 179.413 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 96.7 m-20 -130.72 139.08 50.26 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 120.742 0.306 . . . . 0.0 110.579 -179.791 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 16.3 mmt85 -77.38 134.76 38.36 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.374 -179.677 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 200' ' ' ALA . . . . . 0.494 ' O ' ' N ' ' B' ' 202' ' ' ARG . . . -139.22 90.8 2.45 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.262 179.412 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 201' ' ' GLY . . . . . 0.447 ' C ' ' O ' ' B' ' 200' ' ' ALA . . . 29.66 -90.84 0.01 OUTLIER Glycine 0 CA--C 1.524 0.636 0 O-C-N 123.649 0.593 . . . . 0.0 111.772 179.232 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 202' ' ' ARG . . . . . 0.494 ' N ' ' O ' ' B' ' 200' ' ' ALA . 85.0 mtp180 -41.52 -63.62 0.68 Allowed 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 121.012 -0.275 . . . . 0.0 111.382 179.568 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 70.1 m -157.01 179.64 9.11 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.226 0.536 . . . . 0.0 110.435 -179.125 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 204' ' ' ILE . . . . . 0.604 ' C ' HD12 ' B' ' 204' ' ' ILE . 1.1 pp -88.86 153.16 3.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.128 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 205' ' ' VAL . . . . . 0.505 ' N ' HD12 ' B' ' 204' ' ' ILE . 27.4 m -128.81 161.04 38.71 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.341 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.507 179.605 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 78.0 m-85 -97.58 131.18 44.41 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.229 -179.476 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 14.8 p -144.57 165.94 26.58 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.337 -179.739 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . 34.4 mt -65.51 146.01 55.39 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.485 -179.583 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 13.2 t80 -50.95 -48.46 60.93 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.337 -179.532 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 22.3 p30 -140.89 169.66 17.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.947 0.403 . . . . 0.0 110.441 -179.82 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 211' ' ' THR . . . . . 0.544 ' O ' ' HB3' ' B' ' 214' ' ' ALA . 0.1 OUTLIER -85.31 -17.28 37.31 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.384 -179.867 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 212' ' ' HIS . . . . . . . . . . . . . 85.3 m-70 -44.47 -65.49 0.51 Allowed 'General case' 0 C--O 1.237 0.412 0 CA-C-O 121.03 0.443 . . . . 0.0 110.569 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 11.4 p -48.28 -35.44 5.71 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.283 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 214' ' ' ALA . . . . . 0.544 ' HB3' ' O ' ' B' ' 211' ' ' THR . . . -64.79 -38.27 90.4 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.228 179.351 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 69.2 tp60 -62.21 -46.75 87.51 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 121.202 0.525 . . . . 0.0 110.021 -179.556 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 216' ' ' LEU . . . . . 0.594 HD21 ' HA ' ' A' ' 101' ' ' ALA . 6.8 mp -61.7 -43.54 98.67 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 120.437 -0.505 . . . . 0.0 110.239 -179.409 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 217' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' B' ' 217' ' ' LEU . 95.7 mt -66.1 -36.2 82.53 Favored 'General case' 0 C--O 1.222 -0.347 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.286 179.17 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 89.0 m-20 -59.76 -43.01 94.5 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.094 -179.434 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 219' ' ' GLU . . . . . 0.507 ' O ' ' ND1' ' B' ' 223' ' ' HIS . 96.7 mt-10 -69.57 -52.53 25.38 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.413 179.231 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 220' ' ' ALA . . . . . 0.61 ' HA ' HD21 ' A' ' 97' ' ' LEU . . . -56.5 -45.53 80.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.663 179.724 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 5.1 mm -63.27 -45.17 99.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.761 -179.74 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 91.0 t80 -63.91 -46.96 82.47 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.155 0.502 . . . . 0.0 110.676 179.646 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 223' ' ' HIS . . . . . 0.507 ' ND1' ' O ' ' B' ' 219' ' ' GLU . 46.2 m80 -60.36 -36.44 78.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.468 -179.623 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 224' ' ' SER . . . . . 0.415 ' OG ' ' OE1' ' A' ' 22' ' ' GLN . 10.2 t -76.36 -46.61 26.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.926 0.393 . . . . 0.0 110.836 179.643 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -55.44 -28.87 56.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.326 -179.492 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 55.6 t-80 -79.61 -2.68 43.67 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.695 179.7 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 227' ' ' LEU . . . . . . . . . . . . . 56.6 tp -153.5 104.18 2.72 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.606 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 228' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -173.4 44.97 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.52 179.525 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 229' ' ' LEU . . . . . 0.535 ' N ' HD12 ' B' ' 229' ' ' LEU . 10.7 mp -62.93 -42.37 99.78 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.466 -179.874 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . 145.3 93.75 0.16 Allowed Glycine 0 N--CA 1.46 0.292 0 N-CA-C 110.869 -0.892 . . . . 0.0 110.869 -179.813 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 231' ' ' LEU . . . . . . . . . . . . . 45.4 tp -127.84 129.95 47.81 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.84 0.352 . . . . 0.0 110.673 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 232' ' ' SER . . . . . . . . . . . . . 11.8 t -61.13 -43.54 98.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.593 179.593 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 233' ' ' ASP . . . . . 0.412 ' O ' ' N ' ' B' ' 235' ' ' HIS . 53.5 t0 43.57 78.89 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.774 -179.861 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 234' ' ' ARG . . . . . . . . . . . . . 10.4 tpp85 -60.68 85.52 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 121.074 0.464 . . . . 0.0 110.362 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 235' ' ' HIS . . . . . 0.609 ' N ' ' CD ' ' B' ' 236' ' ' PRO . 0.1 OUTLIER -90.46 -43.23 0.4 Allowed Pre-proline 0 C--N 1.325 -0.472 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.049 179.169 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 236' ' ' PRO . . . . . 0.609 ' CD ' ' N ' ' B' ' 235' ' ' HIS . 57.2 Cg_endo -79.72 144.09 17.17 Favored 'Trans proline' 0 C--N 1.309 -1.518 0 C-N-CA 122.641 2.227 . . . . 0.0 111.828 -178.715 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 237' ' ' SER . . . . . . . . . . . . . 4.0 m -141.74 -22.08 0.73 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.709 179.423 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 238' ' ' ALA . . . . . . . . . . . . . . . -66.82 141.73 57.59 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.576 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.219 -0.799 0 CA-C-O 118.028 -1.429 . . . . 0.0 110.93 179.996 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.268 0 N-CA-C 109.559 -1.416 . . . . 0.0 109.559 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 88.8 m-70 -66.51 -40.05 89.01 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.829 0.347 . . . . 0.0 110.577 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -166.96 114.63 0.59 Allowed Glycine 0 CA--C 1.525 0.666 0 N-CA-C 110.692 -0.963 . . . . 0.0 110.692 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 26.8 m -134.9 162.78 38.03 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.145 0 CA-C-O 120.848 0.356 . . . . 0.0 110.268 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.484 ' CD ' ' N ' ' A' ' 6' ' ' GLU . 1.2 pm0 -133.23 132.39 41.42 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.253 -179.886 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -92.41 46.6 2.59 Favored Glycine 0 CA--C 1.523 0.573 0 N-CA-C 110.798 -0.921 . . . . 0.0 110.798 179.768 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 78.7 ttt-85 -64.66 135.11 55.55 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.715 0.293 . . . . 0.0 110.401 -179.723 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 77.7 m-20 -80.42 165.41 22.24 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.563 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 57.4 mtt180 62.04 62.07 2.35 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.523 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -77.11 46.74 2.03 Favored 'Trans proline' 0 C--N 1.31 -1.483 0 C-N-CA 122.812 2.342 . . . . 0.0 112.015 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 23.8 m -70.37 145.61 51.02 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.336 179.86 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -160.03 72.31 3.11 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.365 179.83 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_exo -60.51 144.15 99.5 Favored 'Trans proline' 0 C--N 1.308 -1.572 0 C-N-CA 122.977 2.451 . . . . 0.0 111.727 179.841 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.402 ' C ' HD12 ' A' ' 15' ' ' LEU . 0.3 OUTLIER -99.92 20.57 14.08 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.088 179.904 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 90.3 m-20 -94.82 -62.04 1.39 Allowed 'General case' 0 C--O 1.236 0.353 0 CA-C-O 121.123 0.487 . . . . 0.0 110.96 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 88.5 p -61.56 -37.51 84.08 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.347 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -66.17 -47.22 74.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.336 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.657 ' O ' HG23 ' A' ' 23' ' ' VAL . . . -56.24 -39.76 73.05 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.701 -0.4 . . . . 0.0 110.211 -179.753 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.565 ' HB1' ' HB3' ' B' ' 155' ' ' LEU . . . -64.04 -54.05 40.34 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.54 -0.464 . . . . 0.0 110.336 179.454 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -58.6 -47.93 82.68 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.29 -179.594 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -62.09 -50.97 69.81 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.984 -179.568 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.657 HG23 ' O ' ' A' ' 19' ' ' ALA . 95.1 t -61.25 -44.52 98.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.31 -179.699 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.1 -41.13 82.86 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.198 179.559 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 69.2 m -59.64 -43.64 93.79 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.137 179.616 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 85.7 m -62.91 -47.82 81.62 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.624 -0.43 . . . . 0.0 110.757 179.65 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 91.6 mt -67.82 -21.47 65.21 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.501 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.465 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 55.9 tt0 -75.33 -56.48 4.67 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.618 179.457 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.434 ' HB1' HH22 ' A' ' 35' ' ' ARG . . . -59.48 -53.9 52.78 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.614 -179.661 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.488 ' O ' ' O ' ' A' ' 31' ' ' ALA . 87.9 mt -47.13 -35.48 7.26 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 120.756 0.312 . . . . 0.0 110.196 -179.09 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.488 ' O ' ' O ' ' A' ' 30' ' ' LEU . . . -57.89 -140.35 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.44 179.103 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.432 ' O ' ' O ' ' A' ' 31' ' ' ALA . 47.2 m 57.65 112.75 0.02 OUTLIER Pre-proline 0 CA--C 1.54 0.574 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.98 -179.726 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' PRO . . . . . 0.419 ' O ' ' N ' ' A' ' 36' ' ' LEU . 51.3 Cg_exo -48.25 -59.07 1.38 Allowed 'Trans proline' 0 N--CA 1.495 1.617 0 C-N-CA 122.211 1.94 . . . . 0.0 113.306 -179.099 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 81.1 p -44.74 -48.36 10.78 Favored 'General case' 0 C--O 1.237 0.445 0 CA-C-O 121.18 0.514 . . . . 0.0 111.014 -178.66 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.434 HH22 ' HB1' ' A' ' 29' ' ' ALA . 84.2 mtp180 -72.46 -24.61 61.22 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.344 179.764 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.544 ' HB3' ' HB1' ' B' ' 139' ' ' ALA . 0.2 OUTLIER -67.2 -55.41 14.22 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 119.901 -0.72 . . . . 0.0 111.337 -178.542 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.417 ' HG2' ' H ' ' A' ' 37' ' ' MET . 5.2 ptp -64.78 -43.76 92.18 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.255 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 97.5 mt -63.12 -45.31 98.96 Favored 'Isoleucine or valine' 0 C--O 1.241 0.63 0 CA-C-O 121.415 0.626 . . . . 0.0 110.477 -179.313 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 5.3 tt -63.21 -41.23 99.11 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.599 179.72 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 31.7 m -59.26 -43.07 92.46 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.077 179.716 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 82.7 mm-40 -56.85 -45.32 82.49 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.545 -0.462 . . . . 0.0 110.019 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.413 ' HA ' HD23 ' A' ' 42' ' ' LEU . 31.7 mt -66.5 -40.08 89.05 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.509 -0.477 . . . . 0.0 110.979 179.006 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 73.8 ttp85 -60.24 -34.2 73.35 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.682 -179.564 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -57.15 -40.11 76.55 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.262 -179.559 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 167.45 170.54 32.4 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 111.052 -0.819 . . . . 0.0 111.052 179.752 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -65.6 144.08 77.39 Favored 'Trans proline' 0 C--N 1.307 -1.624 0 C-N-CA 122.779 2.319 . . . . 0.0 111.809 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 1.9 pp -175.09 146.65 0.96 Allowed Pre-proline 0 C--N 1.325 -0.47 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.869 179.785 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -72.17 167.39 26.95 Favored 'Trans proline' 0 N--CA 1.495 1.566 0 C-N-CA 122.821 2.347 . . . . 0.0 112.19 179.333 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.431 ' CG2' ' N ' ' A' ' 50' ' ' THR . 3.1 m -62.38 -38.41 81.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 121.494 0.664 . . . . 0.0 110.425 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.431 ' N ' ' CG2' ' A' ' 49' ' ' VAL . 73.9 m -58.67 -44.65 90.24 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 114.526 -1.216 . . . . 0.0 110.293 179.781 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.422 ' O ' ' OD1' ' A' ' 51' ' ' ASP . 64.8 t0 -68.21 -37.2 80.63 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.923 -0.581 . . . . 0.0 109.907 178.579 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.672 HD13 ' C ' ' A' ' 52' ' ' LEU . 3.1 tm? -62.83 -44.34 96.41 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 119.988 -0.685 . . . . 0.0 110.25 -179.561 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.02 -43.32 99.07 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.587 179.834 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -60.19 -49.11 78.91 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 120.332 -0.547 . . . . 0.0 110.527 179.676 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.72 -52.35 57.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.035 -179.509 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.686 HG23 ' O ' ' A' ' 56' ' ' ILE . 7.6 tt -176.02 87.76 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.458 -0.073 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.941 -179.461 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -164.92 -57.17 0.02 OUTLIER Glycine 0 CA--C 1.52 0.389 0 N-CA-C 110.353 -1.099 . . . . 0.0 110.353 178.137 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 66.5 mtt 53.73 27.54 7.07 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.285 179.639 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.478 ' HG2' ' H ' ' A' ' 62' ' ' ALA . 70.6 tt0 -165.72 89.35 0.43 Allowed 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -74.1 -21.91 59.7 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.84 -179.328 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 78.1 p -67.15 -41.74 85.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.792 -179.873 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.478 ' H ' ' HG2' ' A' ' 59' ' ' GLU . . . -67.14 -32.12 73.03 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.473 179.78 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 83.6 t -69.99 -51.79 36.7 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.24 0 CA-C-N 116.488 -0.323 . . . . 0.0 110.778 179.829 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 99.3 p -60.33 -38.59 84.23 Favored 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 120.766 -0.374 . . . . 0.0 110.448 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 56.7 t-80 -66.39 -49.94 65.14 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-O 121.036 0.446 . . . . 0.0 110.703 -179.76 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 91.2 mm-40 -63.65 -38.01 89.51 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.242 179.658 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.412 HD21 ' CD1' ' A' ' 87' ' ' TYR . 7.5 tp -61.82 -45.27 94.54 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.002 -0.544 . . . . 0.0 109.776 -179.811 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 60.9 ttt85 -60.63 -45.16 95.09 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.499 -0.48 . . . . 0.0 110.483 -179.621 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 85.5 t -62.74 -54.65 31.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 C-N-CA 120.093 -0.643 . . . . 0.0 110.145 -179.457 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 78.4 mt -58.64 -35.15 72.07 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.08 0.467 . . . . 0.0 110.057 -179.196 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 70.0 ttt180 -60.43 -40.54 91.41 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.304 179.515 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 40.9 t-20 -62.36 -44.03 97.43 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 120.45 -0.5 . . . . 0.0 110.483 -179.387 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.482 HD23 ' N ' ' A' ' 73' ' ' LEU . 6.4 mt -67.88 -39.9 83.61 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.347 -179.212 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 104.66 29.0 5.48 Favored Glycine 0 CA--C 1.526 0.779 0 N-CA-C 110.808 -0.917 . . . . 0.0 110.808 -179.774 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 92.5 mt -90.28 -19.35 24.2 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.869 0.366 . . . . 0.0 110.838 179.761 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 21.8 m -135.82 158.25 39.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.097 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.426 HG23 ' CD2' ' A' ' 90' ' ' TYR . 39.3 t -141.59 155.88 20.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.508 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.416 ' N ' ' CG1' ' A' ' 77' ' ' VAL . . . -117.68 142.19 17.01 Favored Glycine 0 CA--C 1.524 0.649 0 N-CA-C 110.185 -1.166 . . . . 0.0 110.185 178.985 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -114.86 108.34 16.61 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 120.745 0.307 . . . . 0.0 110.311 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 60.9 ttp180 -80.89 131.68 35.38 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.796 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -142.01 120.83 12.71 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.938 0.399 . . . . 0.0 110.506 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 52.72 -117.52 6.66 Favored Glycine 0 CA--C 1.525 0.667 0 N-CA-C 110.533 -1.027 . . . . 0.0 110.533 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 52.9 ttp180 -110.34 34.09 4.12 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.257 0.551 . . . . 0.0 109.904 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 25.8 m -156.99 147.5 21.38 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 179.774 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -130.22 154.92 41.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.098 179.622 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.8 m -128.94 150.19 34.35 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.589 178.636 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.412 ' CD1' HD21 ' A' ' 67' ' ' LEU . 63.1 m-85 -106.81 133.64 51.16 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.061 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 74.5 m -151.23 171.71 16.98 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 64.0 mt -63.99 150.56 44.97 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.584 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.426 ' CD2' HG23 ' A' ' 77' ' ' VAL . 5.5 t80 -52.73 -48.65 66.52 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.398 -179.5 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 90.3 m-20 -139.71 166.92 23.32 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.078 0.466 . . . . 0.0 110.572 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' THR . . . . . 0.481 ' O ' ' HB3' ' A' ' 95' ' ' ALA . 47.9 p -76.11 -24.22 54.96 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.835 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' HIS . . . . . 0.434 ' HB3' ' CD2' ' B' ' 223' ' ' HIS . 68.2 m80 -41.15 -60.12 1.32 Allowed 'General case' 0 C--O 1.237 0.416 0 CA-C-O 121.186 0.517 . . . . 0.0 110.72 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 10.8 m -55.81 -40.1 59.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.925 -0.58 . . . . 0.0 109.957 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.481 ' HB3' ' O ' ' A' ' 92' ' ' THR . . . -56.77 -41.15 77.1 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.987 0.422 . . . . 0.0 110.508 179.855 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.458 ' O ' ' OE1' ' A' ' 100' ' ' GLU . 6.1 tp-100 -64.76 -42.51 95.09 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.137 179.777 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 17.2 tp -59.6 -45.63 91.33 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.188 -0.605 . . . . 0.0 110.341 -178.78 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -65.51 -36.26 83.31 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.103 179.373 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 66.9 t0 -58.77 -43.17 90.33 Favored 'General case' 0 C--N 1.32 -0.706 0 C-N-CA 120.415 -0.514 . . . . 0.0 110.434 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.478 ' N ' ' OE1' ' A' ' 100' ' ' GLU . 2.7 mp0 -69.02 -50.41 49.04 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.484 179.786 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.432 ' HB2' ' CD1' ' B' ' 216' ' ' LEU . . . -59.35 -44.67 92.64 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.759 -0.376 . . . . 0.0 110.38 -179.685 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.571 HD13 HG21 ' B' ' 142' ' ' VAL . 4.8 mm -62.76 -45.04 99.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 C-N-CA 120.666 -0.414 . . . . 0.0 110.42 -179.264 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 73.2 t80 -64.09 -44.45 92.29 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.057 0.456 . . . . 0.0 110.389 179.838 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' HIS . . . . . 0.551 ' CE1' ' CB ' ' B' ' 212' ' ' HIS . 25.7 t60 -59.14 -39.17 81.52 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.74 179.901 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 12.3 t -77.04 -44.57 30.28 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.918 0.39 . . . . 0.0 111.25 179.668 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 79.5 tt0 -55.82 -31.1 62.39 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.472 -179.173 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -52.27 -70.76 0.08 Allowed 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.388 -0.525 . . . . 0.0 110.195 -179.214 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 50.0 mt -109.89 -142.45 0.38 Allowed 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 7.9 p80 -158.02 135.79 10.56 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.716 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.609 ' N ' HD22 ' A' ' 110' ' ' LEU . 3.9 mm? -63.71 -44.59 93.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.506 -179.528 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 67.55 -1.12 7.71 Favored Glycine 0 CA--C 1.526 0.74 0 N-CA-C 110.813 -0.915 . . . . 0.0 110.813 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 83.3 mt -77.65 -110.86 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.818 0.342 . . . . 0.0 110.548 -179.74 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 37.4 t 56.22 57.14 5.21 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.533 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -101.81 39.52 1.45 Allowed 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.538 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -71.29 127.93 34.2 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.141 179.769 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' HIS . . . . . 0.62 ' H ' ' CD ' ' A' ' 117' ' ' PRO . 0.1 OUTLIER -103.9 -43.05 0.18 Allowed Pre-proline 0 C--N 1.331 -0.222 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.473 179.757 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 117' ' ' PRO . . . . . 0.62 ' CD ' ' H ' ' A' ' 116' ' ' HIS . 31.9 Cg_exo -57.81 135.92 72.12 Favored 'Trans proline' 0 C--N 1.306 -1.709 0 C-N-CA 122.392 2.061 . . . . 0.0 111.868 -179.048 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 20.4 t -85.78 -47.52 9.65 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.432 179.602 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -65.14 -39.07 92.49 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.663 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.765 0 CA-C-O 117.986 -1.452 . . . . 0.0 110.936 -179.951 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.242 0 N-CA-C 109.544 -1.423 . . . . 0.0 109.544 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 88.2 m-70 -59.11 -43.0 91.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.853 0.359 . . . . 0.0 110.598 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 123' ' ' GLY . . . . . . . . . . . . . . . -164.9 117.17 0.74 Allowed Glycine 0 CA--C 1.523 0.57 0 N-CA-C 110.621 -0.992 . . . . 0.0 110.621 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 31.8 m -136.08 161.37 37.86 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 CA-C-O 120.907 0.384 . . . . 0.0 110.33 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 125' ' ' GLU . . . . . 0.491 ' CD ' ' N ' ' B' ' 125' ' ' GLU . 1.0 OUTLIER -130.84 133.38 45.88 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.151 -179.931 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -93.23 45.43 2.43 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 110.634 -0.986 . . . . 0.0 110.634 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 127' ' ' ARG . . . . . . . . . . . . . 78.6 ttt-85 -64.04 133.41 53.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.822 0.344 . . . . 0.0 110.388 -179.714 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 128' ' ' ASN . . . . . . . . . . . . . 79.3 m-20 -79.08 166.47 22.25 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.418 -179.816 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 129' ' ' ARG . . . . . . . . . . . . . 68.4 mtt180 61.84 62.1 2.45 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.593 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -75.49 44.07 1.17 Allowed 'Trans proline' 0 C--N 1.309 -1.503 0 C-N-CA 122.729 2.286 . . . . 0.0 111.993 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 73.8 m -64.32 146.54 54.24 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.375 179.686 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 132' ' ' ALA . . . . . . . . . . . . . . . -164.28 71.93 1.65 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.574 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 133' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -68.07 146.73 71.64 Favored 'Trans proline' 0 N--CA 1.491 1.355 0 C-N-CA 122.491 2.128 . . . . 0.0 111.581 -179.758 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 134' ' ' LEU . . . . . 0.435 ' C ' HD12 ' B' ' 134' ' ' LEU . 0.4 OUTLIER -99.62 23.62 9.28 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.301 -179.626 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -94.38 -62.55 1.31 Allowed 'General case' 0 C--O 1.236 0.359 0 CA-C-O 121.117 0.484 . . . . 0.0 110.81 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 78.3 p -62.38 -37.0 84.06 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.328 179.741 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -66.2 -47.28 74.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.267 179.548 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 138' ' ' ALA . . . . . 0.652 ' O ' HG23 ' B' ' 142' ' ' VAL . . . -56.33 -39.61 73.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.076 -179.77 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 139' ' ' ALA . . . . . 0.544 ' HB1' ' HB3' ' A' ' 36' ' ' LEU . . . -64.23 -54.09 38.86 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.512 -0.475 . . . . 0.0 110.392 179.614 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -58.75 -48.03 82.61 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.326 -179.643 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -61.93 -51.21 69.06 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.22 0.533 . . . . 0.0 111.006 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 142' ' ' VAL . . . . . 0.652 HG23 ' O ' ' B' ' 138' ' ' ALA . 96.1 t -61.02 -44.3 97.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.214 -179.699 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -57.5 -41.53 80.95 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 110.062 -0.347 . . . . 0.0 110.062 179.717 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 68.0 m -59.54 -44.08 93.32 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.199 179.831 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 71.4 m -62.8 -48.51 78.81 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 120.99 0.424 . . . . 0.0 110.962 179.768 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 92.7 mt -67.38 -21.59 65.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.528 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 147' ' ' GLN . . . . . 0.471 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 56.2 tt0 -75.3 -56.24 4.92 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.634 179.367 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 148' ' ' ALA . . . . . 0.457 ' HB1' HH22 ' B' ' 154' ' ' ARG . . . -58.94 -53.96 52.47 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.687 -179.552 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.477 ' O ' ' O ' ' B' ' 150' ' ' ALA . 91.2 mt -47.37 -34.92 7.52 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-O 120.846 0.355 . . . . 0.0 110.179 -179.177 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 150' ' ' ALA . . . . . 0.477 ' O ' ' O ' ' B' ' 149' ' ' LEU . . . -58.74 -140.68 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.54 179.177 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 151' ' ' THR . . . . . 0.428 ' O ' ' O ' ' B' ' 150' ' ' ALA . 29.3 m 57.16 112.04 0.02 OUTLIER Pre-proline 0 CA--C 1.54 0.572 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.951 -179.517 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -47.47 -58.39 1.76 Allowed 'Trans proline' 0 N--CA 1.5 1.866 0 C-N-CA 122.396 2.064 . . . . 0.0 113.376 -179.068 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 88.6 p -45.18 -47.67 12.44 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 121.33 0.585 . . . . 0.0 110.858 -178.761 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 154' ' ' ARG . . . . . 0.457 HH22 ' HB1' ' B' ' 148' ' ' ALA . 83.6 mtp180 -73.52 -25.21 60.32 Favored 'General case' 0 C--N 1.319 -0.729 0 C-N-CA 120.338 -0.545 . . . . 0.0 110.291 179.802 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 155' ' ' LEU . . . . . 0.565 ' HB3' ' HB1' ' A' ' 20' ' ' ALA . 0.2 OUTLIER -66.42 -55.98 13.18 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 119.855 -0.738 . . . . 0.0 111.283 -178.337 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.66 -45.28 90.86 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.585 179.5 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 97.0 mt -62.59 -45.23 99.32 Favored 'Isoleucine or valine' 0 C--O 1.241 0.653 0 CA-C-O 121.496 0.665 . . . . 0.0 110.406 -179.207 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 5.8 tt -63.21 -41.24 99.12 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.685 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 83.3 m -59.14 -42.84 91.6 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.843 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 82.4 mm-40 -57.0 -45.24 83.16 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.966 179.516 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 161' ' ' LEU . . . . . 0.407 ' HA ' HD23 ' B' ' 161' ' ' LEU . 33.2 mt -66.26 -40.68 90.32 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.415 -0.514 . . . . 0.0 111.104 178.998 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 162' ' ' ARG . . . . . . . . . . . . . 73.7 ttp85 -60.24 -33.07 71.77 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.704 -179.71 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 17.5 t-20 -58.45 -40.52 82.83 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.383 -179.501 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . 168.58 168.92 31.35 Favored Glycine 0 CA--C 1.525 0.673 0 N-CA-C 110.984 -0.846 . . . . 0.0 110.984 179.827 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -65.83 144.42 77.22 Favored 'Trans proline' 0 C--N 1.308 -1.58 0 C-N-CA 122.836 2.357 . . . . 0.0 111.824 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 2.0 pp -176.23 147.39 0.83 Allowed Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.888 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -72.79 169.14 22.75 Favored 'Trans proline' 0 N--CA 1.496 1.674 0 C-N-CA 122.631 2.221 . . . . 0.0 112.129 179.058 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 168' ' ' VAL . . . . . 0.424 HG23 ' N ' ' B' ' 169' ' ' THR . 3.8 m -63.28 -38.27 81.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 121.446 0.641 . . . . 0.0 110.514 -179.69 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 169' ' ' THR . . . . . 0.424 ' N ' HG23 ' B' ' 168' ' ' VAL . 71.5 m -58.5 -44.81 89.56 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 114.597 -1.183 . . . . 0.0 110.35 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 53.6 t0 -69.03 -36.46 77.78 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.822 178.661 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 171' ' ' LEU . . . . . 0.667 ' C ' HD13 ' B' ' 171' ' ' LEU . 3.1 tm? -63.42 -44.17 95.39 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.001 -0.68 . . . . 0.0 110.308 -179.669 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 172' ' ' ALA . . . . . . . . . . . . . . . -61.0 -43.43 98.9 Favored 'General case' 0 CA--C 1.512 -0.494 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.541 179.738 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -59.93 -48.19 82.72 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 120.284 -0.566 . . . . 0.0 110.403 179.766 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -65.04 -52.77 53.99 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.026 -179.513 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 175' ' ' ILE . . . . . 0.657 ' O ' HG23 ' B' ' 175' ' ' ILE . 7.7 tt -176.17 87.42 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.456 -0.131 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.963 -179.425 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . -164.38 -57.41 0.02 OUTLIER Glycine 0 CA--C 1.522 0.491 0 N-CA-C 110.528 -1.029 . . . . 0.0 110.528 178.25 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 65.3 mtt 53.69 27.47 6.91 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.88 -0.328 . . . . 0.0 110.438 179.684 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 178' ' ' GLU . . . . . 0.507 ' HG2' ' H ' ' B' ' 181' ' ' ALA . 73.8 tt0 -164.62 87.73 0.47 Allowed 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 11.5 mt-30 -73.48 -23.09 60.02 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.822 -179.312 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 78.2 p -66.92 -41.2 87.47 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.86 -179.865 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 181' ' ' ALA . . . . . 0.507 ' H ' ' HG2' ' B' ' 178' ' ' GLU . . . -66.96 -33.29 75.24 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.27 179.739 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 77.9 t -69.69 -51.27 42.64 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.197 0 C-N-CA 120.721 -0.392 . . . . 0.0 110.781 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 92.1 p -59.28 -41.65 89.42 Favored 'General case' 0 C--N 1.332 -0.154 0 C-N-CA 120.675 -0.41 . . . . 0.0 110.566 -179.763 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 63.5 t-80 -66.26 -48.49 70.32 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-O 121.114 0.483 . . . . 0.0 110.757 -179.838 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 25.2 tp60 -63.81 -37.43 87.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.107 -179.835 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 186' ' ' LEU . . . . . 0.426 HD21 ' CD1' ' B' ' 206' ' ' TYR . 9.8 tp -63.22 -44.26 95.78 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.917 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 61.6 ttt85 -59.76 -44.34 93.91 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.614 -0.434 . . . . 0.0 110.23 -179.663 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 90.1 t -63.38 -54.28 34.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 C-N-CA 120.021 -0.672 . . . . 0.0 110.215 -179.669 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 85.6 mt -58.96 -36.09 74.23 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.161 0.505 . . . . 0.0 109.989 -179.111 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 70.1 ttt180 -60.21 -41.91 94.05 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.205 179.412 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 39.2 t-20 -60.37 -47.23 86.94 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 120.431 -0.508 . . . . 0.0 110.388 -179.291 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 192' ' ' LEU . . . . . . . . . . . . . 9.7 mt -65.06 -39.58 93.47 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.918 0.39 . . . . 0.0 110.565 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 193' ' ' GLY . . . . . 0.4 ' O ' ' CD2' ' B' ' 209' ' ' TYR . . . 104.41 28.77 5.63 Favored Glycine 0 CA--C 1.525 0.715 0 N-CA-C 110.855 -0.898 . . . . 0.0 110.855 -179.768 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 92.8 mt -88.86 -19.65 25.62 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.911 0.386 . . . . 0.0 110.758 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 24.6 m -136.05 158.94 39.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.157 -0.474 . . . . 0.0 109.99 179.705 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 196' ' ' VAL . . . . . 0.441 HG23 ' CD2' ' B' ' 209' ' ' TYR . 41.3 t -141.71 156.29 20.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.442 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 197' ' ' GLY . . . . . 0.414 ' N ' ' CG1' ' B' ' 196' ' ' VAL . . . -117.6 142.23 17.07 Favored Glycine 0 CA--C 1.525 0.703 0 N-CA-C 110.202 -1.159 . . . . 0.0 110.202 179.151 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -114.82 108.3 16.57 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 120.664 0.269 . . . . 0.0 110.364 179.829 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 61.4 ttp180 -81.48 133.82 35.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.015 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 200' ' ' ALA . . . . . . . . . . . . . . . -145.15 125.13 13.53 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.536 179.828 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 201' ' ' GLY . . . . . . . . . . . . . . . 50.29 -117.83 5.39 Favored Glycine 0 CA--C 1.526 0.732 0 N-CA-C 110.602 -0.999 . . . . 0.0 110.602 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 202' ' ' ARG . . . . . . . . . . . . . 52.8 ttp180 -111.05 37.79 2.72 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.158 0.504 . . . . 0.0 109.946 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 69.7 m -161.01 150.03 16.59 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.809 -0.441 . . . . 0.0 109.809 179.764 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -132.23 154.18 39.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.1 179.658 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 26.8 m -127.67 150.05 33.16 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.373 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.548 178.828 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 206' ' ' TYR . . . . . 0.426 ' CD1' HD21 ' B' ' 186' ' ' LEU . 65.7 m-85 -106.96 133.74 51.15 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.118 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 58.2 m -151.38 171.79 16.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.274 -179.742 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . 68.9 mt -64.53 150.2 47.19 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.487 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 209' ' ' TYR . . . . . 0.441 ' CD2' HG23 ' B' ' 196' ' ' VAL . 5.9 t80 -52.59 -47.44 66.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.394 -179.59 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 89.0 m-20 -140.19 167.4 22.22 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 121.165 0.507 . . . . 0.0 110.603 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 211' ' ' THR . . . . . 0.498 ' O ' ' HB3' ' B' ' 214' ' ' ALA . 40.9 p -78.17 -23.88 47.48 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.668 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 212' ' ' HIS . . . . . 0.551 ' CB ' ' CE1' ' A' ' 104' ' ' HIS . 65.1 m80 -41.4 -59.46 1.56 Allowed 'General case' 0 C--O 1.236 0.373 0 CA-C-O 121.25 0.547 . . . . 0.0 110.552 -179.892 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 8.7 m -55.87 -41.07 65.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.815 -0.63 . . . . 0.0 109.884 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 214' ' ' ALA . . . . . 0.498 ' HB3' ' O ' ' B' ' 211' ' ' THR . . . -55.52 -40.91 72.4 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.471 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 215' ' ' GLN . . . . . 0.439 ' O ' ' OE1' ' B' ' 219' ' ' GLU . 7.1 tp-100 -65.23 -42.78 93.04 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.217 179.733 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 216' ' ' LEU . . . . . 0.432 ' CD1' ' HB2' ' A' ' 101' ' ' ALA . 12.6 tp -59.25 -46.0 89.67 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.166 -0.614 . . . . 0.0 110.387 -178.784 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -64.98 -37.09 86.49 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.983 179.282 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 43.6 t0 -58.12 -42.42 85.72 Favored 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 120.496 -0.482 . . . . 0.0 110.49 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 219' ' ' GLU . . . . . 0.494 ' OE1' ' N ' ' B' ' 219' ' ' GLU . 2.4 mp0 -69.34 -51.67 34.74 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.505 179.732 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -58.33 -44.67 88.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.346 -179.713 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 221' ' ' ILE . . . . . 0.593 HD13 HG21 ' A' ' 23' ' ' VAL . 4.8 mm -62.67 -44.9 99.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.601 -179.265 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 74.5 t80 -64.55 -43.71 93.11 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.069 0.462 . . . . 0.0 110.299 179.779 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 223' ' ' HIS . . . . . 0.434 ' CD2' ' HB3' ' A' ' 93' ' ' HIS . 12.1 t-80 -59.65 -38.96 82.85 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.693 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 9.7 t -77.1 -44.94 28.68 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.991 0.424 . . . . 0.0 111.295 179.593 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -55.93 -31.16 62.67 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.438 -179.229 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -52.47 -70.91 0.08 Allowed 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.373 -0.531 . . . . 0.0 110.118 -179.326 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 227' ' ' LEU . . . . . . . . . . . . . 50.9 mt -109.23 -142.88 0.38 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.966 0.413 . . . . 0.0 109.902 -179.845 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 228' ' ' HIS . . . . . . . . . . . . . 8.0 p80 -157.97 134.42 9.59 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.582 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 229' ' ' LEU . . . . . 0.602 HD22 ' N ' ' B' ' 229' ' ' LEU . 4.0 mm? -63.13 -44.87 94.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.692 -179.793 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . 67.58 -0.64 9.02 Favored Glycine 0 CA--C 1.527 0.788 0 N-CA-C 110.917 -0.873 . . . . 0.0 110.917 179.847 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 231' ' ' LEU . . . . . . . . . . . . . 80.9 mt -77.48 -110.5 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.777 0.322 . . . . 0.0 110.556 -179.681 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 232' ' ' SER . . . . . . . . . . . . . 37.9 t 55.62 57.47 5.27 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.51 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 233' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -102.73 41.19 1.27 Allowed 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.408 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 234' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -72.65 128.73 36.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.255 179.748 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 235' ' ' HIS . . . . . 0.628 ' H ' ' CD ' ' B' ' 236' ' ' PRO . 0.1 OUTLIER -104.58 -43.03 0.17 Allowed Pre-proline 0 N--CA 1.463 0.222 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.487 179.93 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 236' ' ' PRO . . . . . 0.628 ' CD ' ' H ' ' B' ' 235' ' ' HIS . 31.5 Cg_exo -58.3 136.72 76.4 Favored 'Trans proline' 0 C--N 1.308 -1.604 0 C-N-CA 122.452 2.101 . . . . 0.0 111.876 -179.056 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 237' ' ' SER . . . . . . . . . . . . . 15.7 t -86.18 -48.19 8.79 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.389 179.734 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 238' ' ' ALA . . . . . . . . . . . . . . . -63.85 -39.57 94.52 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.721 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.752 0 CA-C-O 117.985 -1.453 . . . . 0.0 110.961 179.983 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.234 0 N-CA-C 109.481 -1.447 . . . . 0.0 109.481 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 86.8 m-70 -60.9 -44.49 97.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.864 0.364 . . . . 0.0 110.725 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -89.37 111.94 3.92 Favored Glycine 0 CA--C 1.524 0.608 0 N-CA-C 110.967 -0.853 . . . . 0.0 110.967 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.405 ' C ' ' H ' ' A' ' 7' ' ' GLY . 80.0 t -63.34 -45.15 98.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 120.959 0.409 . . . . 0.0 110.632 -179.951 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -75.51 41.95 0.2 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.643 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLY . . . . . 0.405 ' H ' ' C ' ' A' ' 5' ' ' VAL . . . -68.88 141.51 36.43 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 110.921 -0.871 . . . . 0.0 110.921 -179.947 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 82.9 mtp180 -78.28 146.83 34.58 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.822 0.344 . . . . 0.0 110.639 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 75.6 m-20 -72.01 141.33 49.33 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.429 179.84 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.443 ' N ' ' CD ' ' A' ' 11' ' ' PRO . 20.0 ptt180 -156.05 54.58 0.95 Allowed Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.694 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.443 ' CD ' ' N ' ' A' ' 10' ' ' ARG . 46.6 Cg_endo -69.17 164.21 34.82 Favored 'Trans proline' 0 C--N 1.306 -1.68 0 C-N-CA 122.872 2.381 . . . . 0.0 111.893 179.495 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 5.2 m -52.68 134.4 36.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.26 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -170.93 71.81 0.54 Allowed Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.468 -179.751 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -76.58 86.75 1.53 Allowed 'Trans proline' 0 C--N 1.309 -1.552 0 C-N-CA 122.753 2.302 . . . . 0.0 111.979 -179.734 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 57.0 mt -87.81 -127.74 0.05 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.627 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -99.77 -59.2 1.76 Allowed 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.117 0.485 . . . . 0.0 111.169 179.541 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 58.5 m -53.86 -34.48 59.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.455 -179.22 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 47.8 tt0 -68.03 -49.57 60.66 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.649 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.623 ' O ' HG23 ' A' ' 23' ' ' VAL . . . -54.74 -35.85 64.17 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 -179.934 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.32 -52.66 37.66 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.423 179.26 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.99 -49.2 77.63 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.797 0.332 . . . . 0.0 111.0 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -56.06 -50.95 69.54 Favored 'General case' 0 C--O 1.242 0.673 0 CA-C-O 121.279 0.561 . . . . 0.0 110.666 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.623 HG23 ' O ' ' A' ' 19' ' ' ALA . 90.6 t -60.49 -45.09 97.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.784 179.688 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.441 ' HB2' HD12 ' B' ' 155' ' ' LEU . . . -49.17 -46.17 45.04 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 121.014 -0.274 . . . . 0.0 110.391 179.216 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 36.0 t -59.56 -43.95 93.41 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.101 -0.499 . . . . 0.0 109.85 -179.861 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 20.2 m -65.68 -51.27 60.78 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.18 0.514 . . . . 0.0 110.812 179.486 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.544 ' CD1' HD13 ' B' ' 146' ' ' LEU . 4.1 mm? -62.26 -25.58 67.91 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.771 -179.896 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.493 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 54.7 tt0 -75.14 -53.38 8.95 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.849 179.499 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.47 -56.6 19.91 Favored 'General case' 0 CA--C 1.521 -0.171 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.838 -179.232 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.498 ' O ' ' O ' ' A' ' 31' ' ' ALA . 8.0 mp -45.11 -34.91 2.83 Favored 'General case' 0 CA--C 1.516 -0.364 0 C-N-CA 120.958 -0.297 . . . . 0.0 110.214 -179.237 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.498 ' O ' ' O ' ' A' ' 30' ' ' LEU . . . -57.31 -140.48 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.17 0.51 . . . . 0.0 110.357 179.291 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 37.7 m 59.66 110.1 0.02 OUTLIER Pre-proline 0 C--N 1.325 -0.487 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.308 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -51.15 -52.57 8.8 Favored 'Trans proline' 0 N--CA 1.496 1.641 0 C-N-CA 122.372 2.048 . . . . 0.0 113.155 -179.022 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 64.7 m -55.7 -45.48 77.85 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.902 -178.585 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 36.8 ttm180 -61.97 -44.44 96.75 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.733 -179.555 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.405 HD12 ' HB2' ' B' ' 143' ' ' ALA . 8.3 mt -62.08 -48.45 80.16 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.809 -0.356 . . . . 0.0 110.866 -179.666 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.468 ' O ' ' OG1' ' A' ' 40' ' ' THR . 49.8 ttp -53.95 -48.84 69.86 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-O 121.233 0.539 . . . . 0.0 110.204 179.612 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 97.9 mt -64.59 -42.72 95.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 121.342 0.591 . . . . 0.0 110.315 179.451 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 12.0 tp -62.24 -42.77 99.62 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.683 -179.273 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.468 ' OG1' ' O ' ' A' ' 37' ' ' MET . 21.3 p -59.52 -38.78 81.88 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.2 -0.455 . . . . 0.0 109.847 179.799 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.55 ' OE1' HD21 ' A' ' 52' ' ' LEU . 86.8 mt-30 -60.96 -46.47 90.6 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.536 -0.466 . . . . 0.0 110.005 178.798 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 92.8 mt -63.57 -38.78 92.45 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.755 179.268 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.42 ' O ' ' ND2' ' A' ' 44' ' ' ASN . 72.5 ttp85 -50.81 -42.82 58.6 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.418 -179.416 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.42 ' ND2' ' O ' ' A' ' 43' ' ' ARG . 12.8 m120 -135.36 48.81 2.22 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.375 179.582 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -175.23 78.77 0.08 OUTLIER Glycine 0 CA--C 1.529 0.959 0 N-CA-C 111.046 -0.822 . . . . 0.0 111.046 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -79.41 112.38 2.98 Favored 'Trans proline' 0 C--N 1.31 -1.461 0 C-N-CA 122.745 2.297 . . . . 0.0 111.504 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.575 HD12 ' O ' ' A' ' 47' ' ' LEU . 0.3 OUTLIER -160.75 156.01 21.16 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.622 -178.936 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -66.04 -178.66 1.12 Allowed 'Trans proline' 0 C--N 1.309 -1.527 0 C-N-CA 122.696 2.264 . . . . 0.0 111.89 179.034 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.571 HG23 ' N ' ' A' ' 50' ' ' THR . 3.5 m -68.06 -45.7 82.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 121.559 0.695 . . . . 0.0 111.383 -179.836 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.571 ' N ' HG23 ' A' ' 49' ' ' VAL . 58.3 p -55.85 -41.22 74.01 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.364 -0.834 . . . . 0.0 110.454 -179.516 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 66.9 m-20 -74.55 -40.24 61.82 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.507 179.457 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.74 HD23 ' O ' ' A' ' 52' ' ' LEU . 3.7 tt -60.98 -38.43 85.95 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.825 -179.658 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.585 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -69.63 -45.37 68.65 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.146 179.442 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 81.8 tt0 -52.76 -43.42 65.77 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.767 -0.373 . . . . 0.0 110.089 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -62.33 -42.95 99.8 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.538 179.838 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 96.6 mt -84.44 -67.12 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.454 179.588 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLY . . . . . 0.585 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 143.73 70.93 0.02 OUTLIER Glycine 0 CA--C 1.523 0.574 0 N-CA-C 111.141 -0.784 . . . . 0.0 111.141 179.672 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.426 ' C ' ' SD ' ' A' ' 58' ' ' MET . 2.7 tmm? 68.31 97.53 0.06 Allowed 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.76 -0.376 . . . . 0.0 110.762 179.647 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -173.85 24.9 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.078 0.466 . . . . 0.0 110.41 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -70.75 -23.58 62.45 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.044 0.45 . . . . 0.0 110.359 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 9.6 t -66.27 -44.37 83.8 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.584 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.1 -33.22 71.81 Favored 'General case' 0 C--O 1.24 0.605 0 CA-C-N 115.936 -0.575 . . . . 0.0 109.978 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 80.6 t -66.94 -49.99 68.79 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.083 179.713 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 50.5 m -53.04 -42.55 65.86 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 120.985 0.421 . . . . 0.0 110.163 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 83.4 t60 -58.3 -41.26 84.05 Favored 'General case' 0 C--O 1.242 0.697 0 CA-C-O 121.38 0.61 . . . . 0.0 109.63 178.708 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 55.1 tt0 -60.45 -38.86 85.51 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.859 -0.61 . . . . 0.0 109.993 179.249 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.644 ' HA ' HD23 ' A' ' 70' ' ' LEU . 24.0 mt -62.19 -42.35 99.2 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.391 179.861 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -55.26 -47.19 75.83 Favored 'General case' 0 C--O 1.24 0.575 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.874 179.481 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 90.7 t -68.31 -48.76 71.74 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.153 0 CA-C-O 121.172 0.51 . . . . 0.0 110.403 178.686 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.9 HD22 ' CG2' ' A' ' 76' ' ' VAL . 0.1 OUTLIER -49.06 -45.54 43.15 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 -179.277 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.632 ' N ' ' HG ' ' A' ' 70' ' ' LEU . 90.5 mtt-85 -62.35 -43.76 98.07 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.791 -178.508 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ASN . . . . . 0.43 ' C ' HD22 ' A' ' 73' ' ' LEU . 99.2 m-20 -65.34 -41.22 94.13 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.598 179.226 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.543 HD22 ' N ' ' A' ' 73' ' ' LEU . 4.0 mm? -95.61 -64.32 1.07 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.264 -179.135 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' GLY . . . . . 0.658 ' N ' ' O ' ' A' ' 70' ' ' LEU . . . 105.97 83.57 1.65 Allowed Glycine 0 CA--C 1.519 0.33 0 N-CA-C 110.54 -1.024 . . . . 0.0 110.54 -179.249 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 14.7 tp -125.64 -14.63 6.24 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.953 0.406 . . . . 0.0 110.549 -179.77 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.9 ' CG2' HD22 ' A' ' 70' ' ' LEU . 3.3 m -142.71 172.53 8.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.399 -179.763 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.449 HG23 ' HA ' ' A' ' 90' ' ' TYR . 24.6 t -137.62 150.93 25.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.577 178.924 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -128.58 146.92 17.26 Favored Glycine 0 CA--C 1.523 0.578 0 N-CA-C 110.446 -1.062 . . . . 0.0 110.446 179.3 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ASP . . . . . 0.414 ' O ' HD12 ' A' ' 85' ' ' ILE . 96.9 m-20 -120.17 111.27 17.62 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 120.774 0.321 . . . . 0.0 110.435 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 38.5 ptt180 -77.77 151.75 33.9 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.574 179.656 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.455 ' O ' ' N ' ' A' ' 83' ' ' ARG . . . -155.1 94.1 1.6 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.579 179.674 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 57.18 -84.51 0.01 OUTLIER Glycine 0 CA--C 1.524 0.619 0 N-CA-C 110.72 -0.952 . . . . 0.0 110.72 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.455 ' N ' ' O ' ' A' ' 81' ' ' ALA . 35.2 ptt-85 -132.36 31.03 4.11 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 120.71 0.291 . . . . 0.0 110.644 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 41.2 t -146.84 126.13 13.06 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.892 0.377 . . . . 0.0 110.378 -179.787 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.414 HD12 ' O ' ' A' ' 79' ' ' ASP . 1.4 tp -120.86 129.54 75.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.834 179.576 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 64.8 t -107.09 128.57 61.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.029 178.872 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 94.3 m-85 -100.23 130.88 46.41 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.672 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 35.2 p -150.56 169.85 20.53 Favored 'General case' 0 C--O 1.223 -0.301 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 179.791 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 1.056 HD22 ' H ' ' A' ' 89' ' ' LEU . 0.6 OUTLIER -63.74 150.87 43.54 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.661 -179.626 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.466 ' N ' ' HA ' ' A' ' 76' ' ' VAL . 28.4 t80 -51.4 -48.9 62.47 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.244 -178.576 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.531 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 16.0 p-10 -153.05 -178.78 7.15 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.735 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 2.2 m -73.65 -3.26 27.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.422 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 8.5 t-160 -54.01 -74.85 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.062 0.458 . . . . 0.0 110.531 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 11.6 p -57.49 -33.81 45.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.324 -179.521 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.06 -47.67 84.9 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.633 179.694 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.44 ' O ' ' OE2' ' A' ' 100' ' ' GLU . 59.7 tt0 -63.87 -46.52 84.59 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.393 -179.749 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.448 ' CD1' ' HB2' ' B' ' 220' ' ' ALA . 13.8 tp -56.74 -45.7 81.83 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.221 -179.325 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 85.7 mt -63.32 -41.0 98.87 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.38 179.204 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -52.16 -45.04 64.91 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.41 -179.775 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.44 ' OE2' ' O ' ' A' ' 96' ' ' GLN . 0.9 OUTLIER -69.74 -50.46 43.27 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.666 -0.413 . . . . 0.0 110.903 179.782 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.408 ' HB2' ' CD1' ' B' ' 216' ' ' LEU . . . -57.92 -53.55 56.91 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.923 -178.991 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.439 ' N ' ' CD1' ' A' ' 102' ' ' ILE . 1.2 mp -61.74 -44.93 99.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.617 -179.688 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 78.3 t80 -61.23 -50.61 72.39 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 120.492 -0.483 . . . . 0.0 110.804 -179.024 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' HIS . . . . . 0.41 ' CB ' ' CD2' ' B' ' 212' ' ' HIS . 68.7 m-70 -63.29 -36.96 85.4 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.615 -179.654 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 6.2 t -72.07 -46.14 58.04 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.93 179.742 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 81.7 tt0 -60.4 -24.43 65.14 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.187 -179.842 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 12.2 t-80 -72.41 6.95 2.02 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.645 179.588 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.416 ' CG ' ' H ' ' A' ' 109' ' ' HIS . 8.0 tp -136.89 -130.39 0.14 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.719 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 109' ' ' HIS . . . . . 0.416 ' H ' ' CG ' ' A' ' 108' ' ' LEU . 0.1 OUTLIER -156.68 -4.28 0.11 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.667 -179.778 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.448 ' H ' HD12 ' A' ' 110' ' ' LEU . 11.1 mp 40.26 66.03 0.67 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.104 0.478 . . . . 0.0 110.534 -179.78 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -66.27 134.09 33.63 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 110.644 -0.982 . . . . 0.0 110.644 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.421 HD23 ' N ' ' A' ' 112' ' ' LEU . 0.1 OUTLIER -101.03 14.64 31.32 Favored 'General case' 0 N--CA 1.464 0.271 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 -179.608 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 86.4 p 52.33 -161.68 0.1 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.487 -179.762 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' ASP . . . . . 0.521 ' OD1' ' N ' ' A' ' 115' ' ' ARG . 62.0 t0 -132.15 143.34 49.91 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.402 -179.894 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.521 ' N ' ' OD1' ' A' ' 114' ' ' ASP . 33.3 mmt180 -61.79 -157.86 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.404 -179.818 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 24.9 m-70 59.78 71.73 0.86 Allowed Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.504 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_exo -55.39 -31.49 77.72 Favored 'Trans proline' 0 C--N 1.306 -1.668 0 C-N-CA 122.836 2.358 . . . . 0.0 111.943 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 35.5 t -61.59 143.55 55.85 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.549 -179.626 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . 52.14 81.77 0.08 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.566 -179.861 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.681 0 CA-C-O 118.012 -1.438 . . . . 0.0 110.958 -179.923 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.363 0 N-CA-C 109.494 -1.442 . . . . 0.0 109.494 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 88.1 m-70 -65.55 -41.93 92.45 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.686 0.279 . . . . 0.0 110.549 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 123' ' ' GLY . . . . . . . . . . . . . . . -89.84 111.95 3.95 Favored Glycine 0 CA--C 1.523 0.569 0 N-CA-C 111.0 -0.84 . . . . 0.0 111.0 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 89.3 t -63.51 -44.73 98.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.89 0.376 . . . . 0.0 110.587 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 125' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -77.34 43.95 0.4 Allowed 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.528 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -69.75 141.92 35.73 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 110.914 -0.874 . . . . 0.0 110.914 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 127' ' ' ARG . . . . . . . . . . . . . 83.1 mtp180 -78.41 143.98 36.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.83 0.348 . . . . 0.0 110.627 179.854 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 128' ' ' ASN . . . . . . . . . . . . . 70.7 m-80 -69.97 141.41 53.01 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.375 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 129' ' ' ARG . . . . . 0.439 ' N ' ' CD ' ' B' ' 130' ' ' PRO . 20.1 ptt180 -156.44 54.81 0.95 Allowed Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.739 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 130' ' ' PRO . . . . . 0.439 ' CD ' ' N ' ' B' ' 129' ' ' ARG . 48.8 Cg_endo -69.41 165.64 29.88 Favored 'Trans proline' 0 C--N 1.307 -1.618 0 C-N-CA 122.923 2.415 . . . . 0.0 111.92 179.533 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 5.9 m -52.95 135.46 36.59 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.32 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 132' ' ' ALA . . . . . . . . . . . . . . . -172.32 71.57 0.44 Allowed Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.573 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 133' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -77.16 86.67 1.59 Allowed 'Trans proline' 0 C--N 1.309 -1.543 0 C-N-CA 122.659 2.24 . . . . 0.0 111.933 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 55.5 mt -88.15 -126.65 0.05 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.453 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -100.21 -60.56 1.5 Allowed 'General case' 0 C--O 1.236 0.365 0 CA-C-O 121.194 0.521 . . . . 0.0 111.179 179.443 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 42.0 m -52.34 -35.76 51.74 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.435 -179.324 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 40.9 tt0 -66.86 -48.93 67.3 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.625 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 138' ' ' ALA . . . . . 0.645 ' O ' HG23 ' B' ' 142' ' ' VAL . . . -55.35 -35.57 65.36 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 -179.825 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -67.19 -52.83 36.5 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.946 0.403 . . . . 0.0 110.433 179.33 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -58.13 -48.99 78.53 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.749 179.627 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 -56.4 -51.09 69.63 Favored 'General case' 0 C--O 1.241 0.608 0 CA-C-O 121.303 0.573 . . . . 0.0 110.779 -179.708 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 142' ' ' VAL . . . . . 0.645 HG23 ' O ' ' B' ' 138' ' ' ALA . 93.5 t -60.47 -45.0 97.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.688 179.615 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 143' ' ' ALA . . . . . 0.405 ' HB2' HD12 ' A' ' 36' ' ' LEU . . . -49.84 -46.02 50.91 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.467 179.536 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 14.9 t -58.84 -45.89 88.99 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.207 -0.451 . . . . 0.0 109.933 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 22.9 m -64.61 -51.22 63.8 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 121.121 0.486 . . . . 0.0 110.915 179.244 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 146' ' ' LEU . . . . . 0.544 HD13 ' CD1' ' A' ' 27' ' ' LEU . 4.1 mm? -61.63 -26.7 68.16 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.718 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 147' ' ' GLN . . . . . 0.493 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 55.3 tt0 -75.01 -54.31 7.4 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.847 179.611 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -58.06 -55.9 28.92 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.754 -179.203 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.518 ' O ' ' O ' ' B' ' 150' ' ' ALA . 8.6 mp -45.55 -35.17 3.74 Favored 'General case' 0 CA--C 1.513 -0.479 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.264 -179.228 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 150' ' ' ALA . . . . . 0.518 ' O ' ' O ' ' B' ' 149' ' ' LEU . . . -56.79 -140.7 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.114 0.483 . . . . 0.0 110.434 179.32 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 151' ' ' THR . . . . . . . . . . . . . 84.5 m 59.54 109.38 0.03 OUTLIER Pre-proline 0 C--N 1.324 -0.536 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.336 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -50.46 -54.54 5.28 Favored 'Trans proline' 0 N--CA 1.497 1.689 0 C-N-CA 122.407 2.071 . . . . 0.0 113.066 -179.238 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 52.4 m -53.21 -45.7 68.74 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.953 -178.692 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 37.7 ttm180 -62.54 -44.28 96.74 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.749 -179.459 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 155' ' ' LEU . . . . . 0.441 HD12 ' HB2' ' A' ' 24' ' ' ALA . 8.6 mt -62.37 -46.72 87.38 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.831 -0.347 . . . . 0.0 110.918 -179.604 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 156' ' ' MET . . . . . 0.484 ' O ' ' OG1' ' B' ' 159' ' ' THR . 46.6 ttp -55.45 -49.07 73.43 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.298 0.571 . . . . 0.0 110.206 179.623 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 97.0 mt -64.62 -42.84 96.23 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 0 CA-C-O 121.276 0.56 . . . . 0.0 110.258 179.404 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 7.6 tp -62.1 -41.61 98.39 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.7 -179.257 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 159' ' ' THR . . . . . 0.484 ' OG1' ' O ' ' B' ' 156' ' ' MET . 16.9 p -60.67 -38.13 83.88 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.459 . . . . 0.0 109.956 179.85 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 87.1 mt-30 -61.75 -46.27 90.33 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.067 178.837 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 161' ' ' LEU . . . . . 0.414 HD23 ' HA ' ' B' ' 161' ' ' LEU . 90.4 mt -63.59 -38.72 92.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.713 179.267 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 162' ' ' ARG . . . . . 0.471 ' O ' ' ND2' ' B' ' 163' ' ' ASN . 73.7 ttp85 -50.23 -41.0 49.22 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.505 -179.425 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 163' ' ' ASN . . . . . 0.471 ' ND2' ' O ' ' B' ' 162' ' ' ARG . 16.0 m120 -138.4 49.83 1.9 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.376 179.736 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . -175.87 76.89 0.08 OUTLIER Glycine 0 CA--C 1.528 0.887 0 N-CA-C 111.119 -0.792 . . . . 0.0 111.119 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -77.43 114.34 3.71 Favored 'Trans proline' 0 N--CA 1.494 1.535 0 C-N-CA 122.8 2.333 . . . . 0.0 111.593 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 166' ' ' LEU . . . . . 0.492 ' O ' HD12 ' B' ' 166' ' ' LEU . 0.3 OUTLIER -160.36 157.37 24.32 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.656 -178.926 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -65.17 176.69 2.99 Favored 'Trans proline' 0 C--N 1.308 -1.595 0 C-N-CA 122.817 2.345 . . . . 0.0 111.753 179.006 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 168' ' ' VAL . . . . . 0.542 HG23 ' N ' ' B' ' 169' ' ' THR . 3.8 m -63.22 -43.47 98.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 121.522 0.677 . . . . 0.0 111.306 -179.718 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 169' ' ' THR . . . . . 0.542 ' N ' HG23 ' B' ' 168' ' ' VAL . 52.3 p -57.21 -66.65 0.42 Allowed 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.639 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 92.9 m-20 -50.02 -38.69 38.7 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 -179.499 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 171' ' ' LEU . . . . . 0.711 HD23 ' O ' ' B' ' 171' ' ' LEU . 5.0 tt -59.43 -41.91 90.64 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.59 -0.444 . . . . 0.0 109.999 179.531 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 172' ' ' ALA . . . . . 0.598 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -67.66 -43.19 80.84 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.55 -0.296 . . . . 0.0 110.306 179.386 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 85.3 tt0 -53.33 -42.36 66.65 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.054 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -62.83 -40.87 98.76 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.4 179.781 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 96.5 mt -87.87 -68.31 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.314 179.588 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 176' ' ' GLY . . . . . 0.598 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 144.75 72.75 0.02 OUTLIER Glycine 0 CA--C 1.524 0.62 0 N-CA-C 111.078 -0.809 . . . . 0.0 111.078 179.531 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 3.1 tmm? 67.26 97.95 0.05 Allowed 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.673 -0.411 . . . . 0.0 110.591 179.593 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -173.07 22.46 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.204 0.526 . . . . 0.0 110.431 179.684 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -69.15 -24.75 64.12 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.037 0.446 . . . . 0.0 110.384 -179.876 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 12.1 t -65.71 -43.65 88.47 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 121.182 0.515 . . . . 0.0 110.503 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -60.85 -32.41 71.82 Favored 'General case' 0 C--O 1.239 0.53 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.089 179.575 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 182' ' ' VAL . . . . . 0.407 ' O ' ' HG ' ' B' ' 186' ' ' LEU . 94.5 t -67.21 -50.56 62.05 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.375 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.102 179.544 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 70.0 m -53.02 -41.94 65.18 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 121.029 0.442 . . . . 0.0 110.129 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -58.59 -42.22 87.58 Favored 'General case' 0 C--O 1.242 0.676 0 CA-C-O 121.406 0.622 . . . . 0.0 109.788 178.634 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 58.4 tt0 -60.09 -38.67 83.63 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.087 179.282 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 186' ' ' LEU . . . . . 0.69 ' HA ' HD23 ' B' ' 189' ' ' LEU . 22.1 mt -62.24 -42.71 99.56 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-O 120.922 0.392 . . . . 0.0 110.52 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -54.95 -47.19 74.82 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.681 179.439 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 97.0 t -67.79 -48.85 74.11 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.106 0 C-N-CA 120.427 -0.509 . . . . 0.0 110.255 178.664 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 189' ' ' LEU . . . . . 0.901 HD22 ' CG2' ' B' ' 195' ' ' VAL . 0.1 OUTLIER -49.58 -45.4 47.76 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 -179.146 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 190' ' ' ARG . . . . . 0.63 ' N ' ' HG ' ' B' ' 189' ' ' LEU . 90.3 mtt-85 -61.81 -43.21 99.31 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.727 -0.67 . . . . 0.0 109.716 -178.485 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 191' ' ' ASN . . . . . 0.443 ' C ' HD22 ' B' ' 192' ' ' LEU . 99.3 m-20 -66.07 -41.07 91.26 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.937 179.153 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 192' ' ' LEU . . . . . 0.543 ' N ' HD22 ' B' ' 192' ' ' LEU . 4.0 mm? -95.8 -61.63 1.42 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.306 -178.862 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 193' ' ' GLY . . . . . 0.686 ' N ' ' O ' ' B' ' 189' ' ' LEU . . . 103.05 82.47 1.63 Allowed Glycine 0 CA--C 1.52 0.349 0 N-CA-C 110.462 -1.055 . . . . 0.0 110.462 -179.42 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 15.6 tp -124.68 -15.0 6.66 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-O 120.951 0.405 . . . . 0.0 110.743 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 195' ' ' VAL . . . . . 0.901 ' CG2' HD22 ' B' ' 189' ' ' LEU . 3.0 m -142.2 171.91 9.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.376 -179.724 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 196' ' ' VAL . . . . . 0.448 HG23 ' HA ' ' B' ' 209' ' ' TYR . 24.7 t -137.76 152.17 26.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.473 178.745 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 197' ' ' GLY . . . . . . . . . . . . . . . -130.68 148.36 18.7 Favored Glycine 0 CA--C 1.522 0.494 0 N-CA-C 110.54 -1.024 . . . . 0.0 110.54 179.23 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 198' ' ' ASP . . . . . 0.43 ' O ' HD12 ' B' ' 204' ' ' ILE . 89.1 m-20 -120.7 112.87 19.41 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 120.803 0.335 . . . . 0.0 110.621 -179.784 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 37.1 ptt180 -79.13 150.23 31.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.465 179.614 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 200' ' ' ALA . . . . . 0.454 ' O ' ' N ' ' B' ' 202' ' ' ARG . . . -153.46 94.29 1.79 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.649 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 201' ' ' GLY . . . . . . . . . . . . . . . 57.91 -83.34 0.01 OUTLIER Glycine 0 CA--C 1.523 0.565 0 N-CA-C 110.793 -0.923 . . . . 0.0 110.793 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 202' ' ' ARG . . . . . 0.454 ' N ' ' O ' ' B' ' 200' ' ' ALA . 36.3 ptt-85 -133.85 28.87 3.85 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 120.664 0.268 . . . . 0.0 110.722 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 38.8 t -143.89 127.1 16.63 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.293 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 204' ' ' ILE . . . . . 0.43 HD12 ' O ' ' B' ' 198' ' ' ASP . 1.5 tp -121.29 128.39 75.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.161 -0.472 . . . . 0.0 109.894 179.58 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 71.2 t -105.63 129.52 58.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.071 178.846 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -101.27 130.76 47.46 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.675 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 18.0 p -151.13 170.3 19.77 Favored 'General case' 0 C--O 1.223 -0.339 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 208' ' ' LEU . . . . . 1.044 HD22 ' H ' ' B' ' 208' ' ' LEU . 0.5 OUTLIER -63.41 152.07 39.23 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.653 -179.583 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 209' ' ' TYR . . . . . 0.478 ' N ' ' HA ' ' B' ' 195' ' ' VAL . 29.0 t80 -53.96 -48.38 70.37 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.234 -178.578 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 210' ' ' ASP . . . . . 0.531 ' N ' ' OD1' ' B' ' 210' ' ' ASP . 16.3 p-10 -151.56 179.8 8.06 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.74 179.806 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 2.5 m -74.19 -1.81 22.01 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.473 -179.842 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 212' ' ' HIS . . . . . 0.41 ' CD2' ' CB ' ' A' ' 104' ' ' HIS . 9.0 t-160 -56.04 -73.63 0.06 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.992 0.425 . . . . 0.0 110.46 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 9.6 p -57.54 -33.02 43.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.319 -179.609 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 214' ' ' ALA . . . . . . . . . . . . . . . -61.34 -47.96 83.52 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.637 179.699 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 215' ' ' GLN . . . . . 0.443 ' O ' ' OE1' ' B' ' 219' ' ' GLU . 59.4 tt0 -63.69 -46.28 86.23 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.338 -179.698 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 216' ' ' LEU . . . . . 0.408 ' CD1' ' HB2' ' A' ' 101' ' ' ALA . 14.5 tp -56.58 -46.11 80.98 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.217 -179.262 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 86.0 mt -63.53 -39.63 94.92 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.281 179.284 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -52.79 -45.44 67.17 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.4 -179.772 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 219' ' ' GLU . . . . . 0.443 ' OE1' ' O ' ' B' ' 215' ' ' GLN . 1.1 mp0 -70.44 -48.53 55.49 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.98 179.761 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 220' ' ' ALA . . . . . 0.448 ' HB2' ' CD1' ' A' ' 97' ' ' LEU . . . -59.21 -53.4 58.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.046 -179.003 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 221' ' ' ILE . . . . . 0.437 ' N ' ' CD1' ' B' ' 221' ' ' ILE . 1.2 mp -62.27 -44.82 99.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.663 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 75.9 t80 -61.07 -49.9 75.46 Favored 'General case' 0 C--N 1.32 -0.691 0 C-N-CA 120.475 -0.49 . . . . 0.0 110.747 -179.088 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 223' ' ' HIS . . . . . . . . . . . . . 56.4 m-70 -64.06 -37.18 86.49 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.727 -179.74 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 9.1 t -71.69 -45.99 60.16 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.915 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -60.71 -23.63 65.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.369 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 9.8 t-80 -72.47 7.16 1.95 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.615 179.511 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 227' ' ' LEU . . . . . 0.428 HD23 ' H ' ' B' ' 229' ' ' LEU . 4.8 tp -138.19 -131.97 0.13 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.697 -179.837 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 228' ' ' HIS . . . . . 0.415 ' H ' ' CG ' ' B' ' 227' ' ' LEU . 0.1 OUTLIER -154.73 -2.7 0.16 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.735 -179.871 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 229' ' ' LEU . . . . . 0.442 ' H ' HD12 ' B' ' 229' ' ' LEU . 11.0 mp 39.57 65.73 0.67 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.271 0.558 . . . . 0.0 110.49 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -65.16 134.01 36.64 Favored Glycine 0 CA--C 1.525 0.663 0 N-CA-C 110.663 -0.975 . . . . 0.0 110.663 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 231' ' ' LEU . . . . . 0.406 HD23 ' N ' ' B' ' 231' ' ' LEU . 0.1 OUTLIER -101.7 14.88 30.65 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 110.131 -0.322 . . . . 0.0 110.131 -179.771 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 232' ' ' SER . . . . . . . . . . . . . 82.1 p 52.1 -160.98 0.1 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.586 -179.695 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 233' ' ' ASP . . . . . 0.524 ' OD1' ' N ' ' B' ' 234' ' ' ARG . 66.2 t0 -133.64 140.57 47.17 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.458 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 234' ' ' ARG . . . . . 0.524 ' N ' ' OD1' ' B' ' 233' ' ' ASP . 34.2 mmt180 -58.65 -158.9 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.381 -179.807 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 235' ' ' HIS . . . . . . . . . . . . . 25.9 m-70 60.91 71.86 0.77 Allowed Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.62 -179.731 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 236' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_exo -54.89 -32.93 80.09 Favored 'Trans proline' 0 C--N 1.307 -1.643 0 C-N-CA 122.824 2.349 . . . . 0.0 111.991 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 237' ' ' SER . . . . . . . . . . . . . 47.3 t -60.11 145.76 45.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.43 -179.601 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 238' ' ' ALA . . . . . . . . . . . . . . . 48.39 81.15 0.05 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.469 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.75 0 CA-C-O 118.022 -1.432 . . . . 0.0 110.907 179.865 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.263 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 80.5 m80 -85.34 125.42 32.93 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.848 0.356 . . . . 0.0 110.442 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -74.55 150.84 42.28 Favored Glycine 0 CA--C 1.523 0.549 0 N-CA-C 110.815 -0.914 . . . . 0.0 110.815 179.857 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 64.8 t -125.02 132.12 71.7 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.383 0 CA-C-O 120.849 0.357 . . . . 0.0 110.172 179.816 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 82.3 tt0 -90.57 99.03 12.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.038 179.796 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLY . . . . . 0.45 ' O ' ' O ' ' A' ' 8' ' ' ARG . . . -91.34 2.28 77.93 Favored Glycine 0 CA--C 1.523 0.562 0 N-CA-C 110.941 -0.863 . . . . 0.0 110.941 179.87 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.45 ' O ' ' O ' ' A' ' 7' ' ' GLY . 96.2 mtt-85 50.85 104.64 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.779 0.323 . . . . 0.0 110.439 -179.911 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 68.9 m-20 -147.79 170.51 17.44 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.927 0.394 . . . . 0.0 110.449 -179.822 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 9.1 tpp85 -157.96 63.45 2.72 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.69 -179.804 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -74.15 160.55 42.38 Favored 'Trans proline' 0 C--N 1.308 -1.6 0 C-N-CA 122.951 2.434 . . . . 0.0 112.263 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 82.5 p -72.55 164.15 26.9 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.253 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -155.62 62.6 3.28 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.541 -179.84 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -70.19 154.67 65.84 Favored 'Trans proline' 0 C--N 1.31 -1.498 0 C-N-CA 122.891 2.394 . . . . 0.0 111.654 179.795 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.494 HD23 ' H ' ' A' ' 15' ' ' LEU . 0.1 OUTLIER -82.12 8.9 9.63 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.177 -179.696 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -96.35 -62.3 1.3 Allowed 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.12 0.486 . . . . 0.0 110.768 179.409 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 46.0 m -59.18 -33.35 70.84 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.228 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -67.56 -49.15 64.57 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.496 179.69 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -57.95 -36.07 72.02 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.927 -0.309 . . . . 0.0 110.289 -179.826 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.71 -53.52 26.9 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 120.884 0.373 . . . . 0.0 110.492 179.637 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.08 -42.07 99.55 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.912 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 16.5 mm100 -61.32 -52.9 62.75 Favored 'General case' 0 C--O 1.239 0.509 0 CA-C-O 121.304 0.573 . . . . 0.0 110.644 -179.603 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 74.4 t -62.19 -47.09 94.75 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.854 179.589 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -53.13 -42.81 66.4 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 120.809 -0.356 . . . . 0.0 110.252 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 50.0 m -59.55 -43.39 93.56 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.332 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 17.6 m -64.42 -51.98 60.47 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 120.449 -0.5 . . . . 0.0 110.725 179.769 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.445 ' N ' ' CD1' ' A' ' 27' ' ' LEU . 7.9 mp -66.16 -20.02 66.01 Favored 'General case' 0 CA--C 1.513 -0.457 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.615 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.445 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 54.1 tt0 -74.01 -63.44 1.22 Allowed 'General case' 0 C--N 1.32 -0.687 0 O-C-N 123.418 0.449 . . . . 0.0 110.842 179.697 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -57.47 -51.96 67.32 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.939 -179.191 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.437 ' O ' ' C ' ' A' ' 31' ' ' ALA . 4.1 mm? -54.52 -39.15 67.35 Favored 'General case' 0 CA--C 1.508 -0.645 0 C-N-CA 120.876 -0.329 . . . . 0.0 110.279 -178.851 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.555 ' O ' ' C ' ' A' ' 32' ' ' THR . . . -37.67 -69.31 0.12 Allowed 'General case' 0 CA--C 1.511 -0.549 0 O-C-N 123.531 0.519 . . . . 0.0 110.062 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.555 ' C ' ' O ' ' A' ' 31' ' ' ALA . 15.9 m -5.57 111.57 0.03 OUTLIER Pre-proline 0 CA--C 1.54 0.595 0 O-C-N 124.851 1.344 . . . . 0.0 111.124 -179.334 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_exo -45.75 -42.9 19.39 Favored 'Trans proline' 0 C--N 1.309 -1.511 0 C-N-CA 122.246 1.964 . . . . 0.0 112.652 -178.008 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 67.5 m -57.66 -46.69 83.9 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.609 -179.481 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -67.06 -36.85 82.93 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.053 0.454 . . . . 0.0 110.179 179.622 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.465 HD13 ' O ' ' A' ' 36' ' ' LEU . 0.2 OUTLIER -59.2 -52.85 63.91 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 120.097 -0.641 . . . . 0.0 110.725 -178.047 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 64.2 ttp -62.74 -44.48 96.1 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.938 179.732 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 89.3 mt -60.26 -44.56 95.89 Favored 'Isoleucine or valine' 0 C--O 1.242 0.678 0 CA-C-O 121.584 0.707 . . . . 0.0 110.685 -178.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -63.84 -39.0 93.18 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.632 179.639 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 14.9 m -59.02 -39.32 81.57 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.797 179.717 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -62.31 -44.77 95.73 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.235 179.627 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.449 ' O ' ' N ' ' A' ' 45' ' ' GLY . 23.6 mt -62.51 -43.12 99.58 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 120.504 -0.478 . . . . 0.0 111.293 179.686 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.504 HH21 ' CG ' ' A' ' 99' ' ' ASP . 79.3 ttt-85 -40.14 -31.12 0.11 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.685 -179.703 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 78.3 m-20 -60.07 -42.3 94.25 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.267 -179.497 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.449 ' N ' ' O ' ' A' ' 42' ' ' LEU . . . 126.29 -116.08 2.46 Favored Glycine 0 CA--C 1.535 1.339 0 N-CA-C 111.384 -0.686 . . . . 0.0 111.384 179.204 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -73.95 128.83 12.7 Favored 'Trans proline' 0 N--CA 1.495 1.609 0 C-N-CA 122.271 1.981 . . . . 0.0 112.434 -179.153 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -176.33 86.46 0.27 Allowed Pre-proline 0 C--N 1.327 -0.407 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.445 179.443 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -49.35 171.12 0.08 OUTLIER 'Trans proline' 0 C--N 1.306 -1.688 0 C-N-CA 122.742 2.294 . . . . 0.0 112.281 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 70.4 t -55.4 -44.28 75.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.25 -179.531 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 19.0 m -61.75 -44.32 97.12 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.284 179.207 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 66.2 t0 -63.94 -40.35 96.25 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-O 121.383 0.611 . . . . 0.0 110.296 179.692 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.616 HD23 ' O ' ' A' ' 52' ' ' LEU . 5.1 tt -61.31 -44.19 97.62 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.778 -0.646 . . . . 0.0 109.831 -179.741 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.579 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -59.21 -43.73 92.27 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 179.543 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 84.7 tt0 -54.56 -47.05 73.72 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.068 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -57.89 -49.98 74.87 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.546 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.455 HD12 ' CD2' ' A' ' 52' ' ' LEU . 96.8 mt -85.36 -73.76 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.522 -0.126 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.238 179.688 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLY . . . . . 0.579 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 131.74 77.37 0.14 Allowed Glycine 0 N--CA 1.461 0.331 0 N-CA-C 111.472 -0.651 . . . . 0.0 111.472 179.218 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.473 ' CB ' ' O ' ' A' ' 57' ' ' GLY . 23.2 ttm 80.93 99.26 0.06 Allowed 'General case' 0 C--O 1.234 0.239 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.955 178.867 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 179.32 22.18 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.165 179.776 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 55.3 mt-30 -56.92 -27.82 61.34 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 120.825 0.345 . . . . 0.0 111.135 -179.145 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 45.7 m -70.04 -45.83 66.33 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 120.931 0.396 . . . . 0.0 111.212 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.26 -29.3 70.65 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.116 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 70.0 t -72.66 -52.21 24.25 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.246 0 C-N-CA 120.546 -0.461 . . . . 0.0 110.596 179.751 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 11.1 t -55.2 -43.37 74.34 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.303 -0.559 . . . . 0.0 110.558 -179.383 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 60.0 t-80 -69.62 -49.45 53.81 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.364 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 11.1 tp-100 -58.98 -45.35 90.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.58 -179.231 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.401 ' O ' ' CG ' ' A' ' 71' ' ' ARG . 3.1 mm? -63.63 -40.11 96.06 Favored 'General case' 0 CA--C 1.502 -0.878 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.479 -179.885 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 72.1 ttt180 -58.24 -43.63 87.89 Favored 'General case' 0 C--N 1.303 -1.414 0 C-N-CA 120.016 -0.673 . . . . 0.0 110.099 179.364 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 91.9 t -67.84 -53.83 27.52 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.385 179.692 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.599 ' O ' ' N ' ' A' ' 74' ' ' GLY . 94.2 mt -57.93 -38.38 75.83 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-N 116.151 -0.477 . . . . 0.0 109.807 -179.507 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.401 ' CG ' ' O ' ' A' ' 67' ' ' LEU . 11.0 mmm180 -59.93 -43.42 94.95 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.139 179.658 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ASN . . . . . 0.42 ' CB ' HD23 ' A' ' 73' ' ' LEU . 88.1 m-20 -64.88 -43.44 92.92 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 120.466 -0.494 . . . . 0.0 110.314 179.78 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.42 HD23 ' CB ' ' A' ' 72' ' ' ASN . 0.4 OUTLIER -153.93 73.02 0.92 Allowed 'General case' 0 C--N 1.334 -0.067 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.755 179.28 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 74' ' ' GLY . . . . . 0.599 ' N ' ' O ' ' A' ' 70' ' ' LEU . . . -147.2 1.05 0.73 Allowed Glycine 0 N--CA 1.464 0.564 0 N-CA-C 110.882 -0.887 . . . . 0.0 110.882 -179.738 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.577 HD22 ' N ' ' A' ' 75' ' ' LEU . 3.8 mm? 55.43 61.25 2.95 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.849 0.357 . . . . 0.0 110.994 179.523 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 34.0 m -132.52 156.25 42.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.193 179.217 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.727 HG12 ' N ' ' A' ' 78' ' ' GLY . 60.3 t -131.83 174.04 13.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.239 -179.651 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.727 ' N ' HG12 ' A' ' 77' ' ' VAL . . . -165.29 159.21 32.32 Favored Glycine 0 CA--C 1.526 0.739 0 N-CA-C 110.519 -1.032 . . . . 0.0 110.519 179.07 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 -115.67 116.52 28.24 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 120.753 0.311 . . . . 0.0 110.697 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 62.3 ttp180 -86.69 137.71 32.24 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.272 179.672 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.446 ' O ' ' N ' ' A' ' 83' ' ' ARG . . . -148.8 172.85 13.97 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.483 -179.766 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -41.22 94.96 0.01 OUTLIER Glycine 0 CA--C 1.527 0.823 0 N-CA-C 111.023 -0.831 . . . . 0.0 111.023 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.446 ' N ' ' O ' ' A' ' 81' ' ' ALA . 17.5 mmm180 50.13 45.02 25.99 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.886 0.374 . . . . 0.0 110.629 179.888 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 28.5 t -160.23 108.68 1.69 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.548 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 2.2 tp -116.22 129.77 72.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 120.942 0.401 . . . . 0.0 110.064 179.552 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 72.8 t -106.67 131.1 57.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 179.037 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 99.7 m-85 -106.35 130.44 54.18 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.621 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 66.9 m -150.5 171.04 17.7 Favored 'General case' 0 C--N 1.341 0.2 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 49.4 mt -79.24 146.82 32.82 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.56 -179.707 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 6.0 t80 -56.08 -48.06 76.8 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.654 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 75.6 m-20 -125.47 176.39 6.85 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 116.433 -0.348 . . . . 0.0 110.291 -179.768 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 22.3 p -99.8 -1.84 36.57 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.323 -179.688 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' HIS . . . . . 0.572 ' CE1' ' CD2' ' B' ' 223' ' ' HIS . 60.8 m80 -53.61 -55.33 26.77 Favored 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 120.855 -0.338 . . . . 0.0 110.376 -179.817 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.491 ' HA ' HD21 ' A' ' 97' ' ' LEU . 61.4 t -44.5 -39.01 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.047 0.451 . . . . 0.0 110.322 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -71.68 -36.5 70.64 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.939 179.555 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 96.2 mm-40 -64.3 -53.28 51.44 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.188 0.518 . . . . 0.0 111.285 -178.719 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.491 HD21 ' HA ' ' A' ' 94' ' ' VAL . 3.2 pp -67.94 -39.93 83.39 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.557 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.447 ' N ' HD12 ' A' ' 97' ' ' LEU . 6.4 tt -65.36 -41.37 93.88 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.226 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' ASP . . . . . 0.504 ' CG ' HH21 ' A' ' 43' ' ' ARG . 78.4 m-20 -61.86 -38.35 87.93 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.845 -179.646 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.424 ' OE2' ' OE2' ' B' ' 219' ' ' GLU . 97.9 mt-10 -71.67 -44.68 63.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.847 179.308 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -63.06 -49.83 72.99 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.57 -179.637 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.425 HD13 ' HG ' ' A' ' 98' ' ' LEU . 1.2 mp -63.77 -43.83 98.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.875 178.976 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 89.2 t80 -60.02 -47.82 84.26 Favored 'General case' 0 C--N 1.313 -0.991 0 C-N-CA 120.626 -0.43 . . . . 0.0 110.831 -179.26 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' HIS . . . . . 0.519 ' CD2' ' CE1' ' B' ' 212' ' ' HIS . 11.7 t-160 -66.65 -35.98 81.47 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.124 179.765 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 4.4 t -73.3 -49.61 26.64 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.002 0.43 . . . . 0.0 111.487 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -67.28 -21.18 65.71 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.626 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 19.8 t60 -51.13 -69.79 0.1 Allowed 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 120.694 -0.403 . . . . 0.0 110.426 -179.277 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 58.4 mt -78.19 -57.95 3.52 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.965 0.412 . . . . 0.0 110.632 -179.743 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 64.7 t-80 44.37 86.86 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.615 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 93.8 mt -62.9 -42.94 99.96 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.598 -179.755 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 75.46 5.21 77.12 Favored Glycine 0 N--CA 1.453 -0.17 0 N-CA-C 110.805 -0.918 . . . . 0.0 110.805 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.579 HD13 ' N ' ' A' ' 113' ' ' SER . 0.2 OUTLIER -115.47 115.17 26.06 Favored 'General case' 0 CA--C 1.521 -0.158 0 CA-C-O 120.833 0.349 . . . . 0.0 110.228 -179.831 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.579 ' N ' HD13 ' A' ' 112' ' ' LEU . 41.3 t -154.33 166.06 34.39 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.506 179.489 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 114' ' ' ASP . . . . . 0.409 ' OD1' ' O ' ' A' ' 114' ' ' ASP . 47.2 p-10 -90.16 91.0 8.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.651 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 80.2 mmt-85 -79.98 148.14 31.29 Favored 'General case' 0 CA--C 1.515 -0.376 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.48 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 2.9 p-80 -155.01 151.58 23.38 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.406 179.77 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo -67.02 -70.89 0.02 OUTLIER 'Trans proline' 0 N--CA 1.494 1.501 0 C-N-CA 122.564 2.176 . . . . 0.0 112.252 179.638 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 30.6 p -80.65 159.65 25.28 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.654 -179.696 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -69.93 143.76 52.61 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.555 179.849 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.675 0 CA-C-O 117.885 -1.508 . . . . 0.0 110.928 179.992 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.299 0 N-CA-C 109.591 -1.404 . . . . 0.0 109.591 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 80.1 m80 -98.18 126.33 43.59 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.881 0.372 . . . . 0.0 110.283 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 123' ' ' GLY . . . . . . . . . . . . . . . -73.13 149.49 42.65 Favored Glycine 0 CA--C 1.523 0.552 0 N-CA-C 110.693 -0.963 . . . . 0.0 110.693 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 56.7 t -124.33 130.52 73.61 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 CA-C-O 120.88 0.372 . . . . 0.0 110.11 179.764 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 125' ' ' GLU . . . . . . . . . . . . . 79.4 tt0 -88.86 97.91 11.43 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.153 179.874 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 126' ' ' GLY . . . . . 0.439 ' O ' ' O ' ' B' ' 127' ' ' ARG . . . -90.62 0.72 77.63 Favored Glycine 0 CA--C 1.523 0.575 0 N-CA-C 110.835 -0.906 . . . . 0.0 110.835 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 127' ' ' ARG . . . . . 0.439 ' O ' ' O ' ' B' ' 126' ' ' GLY . 96.2 mtt-85 51.97 106.07 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.85 0.357 . . . . 0.0 110.485 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 128' ' ' ASN . . . . . . . . . . . . . 69.1 m-20 -148.69 171.07 16.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.467 -179.787 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 129' ' ' ARG . . . . . . . . . . . . . 9.0 tpp85 -158.73 62.03 2.1 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.664 -179.883 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -73.32 161.74 42.05 Favored 'Trans proline' 0 C--N 1.307 -1.643 0 C-N-CA 122.891 2.394 . . . . 0.0 112.293 -179.876 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 10.4 p -73.24 163.53 27.97 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.199 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 132' ' ' ALA . . . . . . . . . . . . . . . -154.9 64.36 4.27 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.524 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 133' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -71.94 154.09 58.12 Favored 'Trans proline' 0 C--N 1.312 -1.377 0 C-N-CA 122.879 2.386 . . . . 0.0 111.778 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 134' ' ' LEU . . . . . 0.525 ' H ' HD23 ' B' ' 134' ' ' LEU . 0.1 OUTLIER -81.68 8.73 9.19 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.948 -179.78 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 92.8 m-20 -96.19 -62.25 1.31 Allowed 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.222 0.534 . . . . 0.0 110.722 179.54 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 65.0 m -59.85 -33.04 71.26 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.323 179.803 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 36.3 mt-30 -67.88 -49.52 61.55 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.467 179.741 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 138' ' ' ALA . . . . . 0.456 ' O ' HG23 ' B' ' 142' ' ' VAL . . . -57.49 -35.63 70.45 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.89 -0.324 . . . . 0.0 110.287 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -67.54 -53.35 29.14 Favored 'General case' 0 CA--C 1.528 0.133 0 C-N-CA 120.759 -0.377 . . . . 0.0 110.534 179.615 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -63.06 -41.31 99.42 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.872 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 19.6 mm100 -62.08 -52.86 62.21 Favored 'General case' 0 C--O 1.239 0.542 0 CA-C-O 121.068 0.461 . . . . 0.0 110.603 -179.571 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 142' ' ' VAL . . . . . 0.456 HG23 ' O ' ' B' ' 138' ' ' ALA . 84.2 t -62.28 -46.96 95.22 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 179.598 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -53.17 -43.11 66.83 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.193 179.682 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 69.3 m -59.17 -44.45 92.16 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.426 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 21.6 m -64.52 -51.5 62.6 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.715 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 146' ' ' LEU . . . . . 0.418 ' N ' ' CD1' ' B' ' 146' ' ' LEU . 8.3 mp -66.09 -20.16 66.07 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.681 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 147' ' ' GLN . . . . . 0.471 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 58.3 tt0 -74.62 -62.93 1.36 Allowed 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.889 179.818 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -57.91 -52.55 65.01 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.138 -179.12 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.427 ' O ' ' C ' ' B' ' 150' ' ' ALA . 4.2 mm? -53.78 -37.57 63.58 Favored 'General case' 0 CA--C 1.508 -0.665 0 C-N-CA 120.794 -0.362 . . . . 0.0 110.194 -178.884 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 150' ' ' ALA . . . . . 0.552 ' O ' ' C ' ' B' ' 151' ' ' THR . . . -39.31 -70.16 0.11 Allowed 'General case' 0 CA--C 1.511 -0.543 0 O-C-N 123.483 0.49 . . . . 0.0 110.136 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 151' ' ' THR . . . . . 0.552 ' C ' ' O ' ' B' ' 150' ' ' ALA . 11.2 m -5.19 111.43 0.03 OUTLIER Pre-proline 0 N--CA 1.471 0.624 0 O-C-N 124.827 1.329 . . . . 0.0 111.07 -179.301 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -45.55 -42.43 18.46 Favored 'Trans proline' 0 C--N 1.307 -1.634 0 C-N-CA 122.26 1.973 . . . . 0.0 112.686 -177.806 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 73.0 m -58.02 -45.89 86.18 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.53 -179.6 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 92.9 mtt180 -68.17 -37.08 80.6 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.191 0.519 . . . . 0.0 110.251 179.55 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 155' ' ' LEU . . . . . 0.473 ' O ' HD13 ' B' ' 155' ' ' LEU . 0.2 OUTLIER -59.86 -52.88 63.55 Favored 'General case' 0 C--N 1.32 -0.703 0 C-N-CA 120.032 -0.667 . . . . 0.0 111.009 -178.155 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 65.5 ttp -62.83 -44.13 96.96 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.706 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 80.3 mt -60.38 -44.58 96.34 Favored 'Isoleucine or valine' 0 C--O 1.241 0.636 0 CA-C-O 121.478 0.656 . . . . 0.0 110.465 -179.144 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -63.38 -39.81 95.53 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.662 179.335 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 25.0 m -57.94 -39.89 79.16 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.725 179.594 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 98.9 mm-40 -61.71 -45.1 95.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.236 179.721 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 161' ' ' LEU . . . . . 0.431 ' O ' ' N ' ' B' ' 164' ' ' GLY . 21.8 mt -62.8 -43.13 99.62 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 120.442 -0.503 . . . . 0.0 111.256 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 162' ' ' ARG . . . . . 0.501 HH21 ' CG ' ' B' ' 218' ' ' ASP . 78.9 ttt-85 -40.46 -30.15 0.1 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.736 -179.834 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 82.3 m-20 -60.48 -42.66 96.71 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.293 -179.333 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 164' ' ' GLY . . . . . 0.431 ' N ' ' O ' ' B' ' 161' ' ' LEU . . . 127.57 -114.89 2.0 Favored Glycine 0 CA--C 1.538 1.469 0 N-CA-C 111.191 -0.764 . . . . 0.0 111.191 179.252 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -75.8 129.09 11.34 Favored 'Trans proline' 0 N--CA 1.494 1.552 0 C-N-CA 122.4 2.067 . . . . 0.0 112.331 -179.537 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -175.91 84.14 0.29 Allowed Pre-proline 0 C--N 1.327 -0.394 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.242 179.457 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 55.1 Cg_exo -48.1 171.79 0.05 OUTLIER 'Trans proline' 0 C--N 1.305 -1.72 0 C-N-CA 122.756 2.304 . . . . 0.0 112.3 -179.847 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . 72.3 t -55.26 -44.96 77.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.317 -179.438 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 169' ' ' THR . . . . . . . . . . . . . 13.2 m -62.36 -44.46 96.42 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.367 179.18 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 64.3 t0 -63.3 -39.92 95.9 Favored 'General case' 0 C--O 1.24 0.553 0 CA-C-O 121.433 0.635 . . . . 0.0 110.162 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 171' ' ' LEU . . . . . 0.61 HD23 ' O ' ' B' ' 171' ' ' LEU . 4.5 tt -62.12 -43.91 97.81 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.81 -179.665 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 172' ' ' ALA . . . . . 0.577 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -59.42 -43.94 92.98 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 179.717 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 82.2 tt0 -54.46 -46.78 73.38 Favored 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 120.615 -0.434 . . . . 0.0 109.996 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -58.7 -50.76 72.7 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 120.683 -0.407 . . . . 0.0 110.693 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 93.8 mt -83.97 -73.53 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.102 179.617 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 176' ' ' GLY . . . . . 0.577 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 131.34 77.9 0.16 Allowed Glycine 0 C--N 1.332 0.309 0 N-CA-C 111.567 -0.613 . . . . 0.0 111.567 179.429 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 177' ' ' MET . . . . . 0.456 ' CB ' ' O ' ' B' ' 176' ' ' GLY . 23.9 ttm 79.94 99.39 0.06 Allowed 'General case' 0 C--O 1.233 0.229 0 C-N-CA 120.801 -0.36 . . . . 0.0 111.01 178.793 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 178' ' ' GLU . . . . . 0.424 ' OE1' ' O ' ' B' ' 177' ' ' MET . 1.3 tp10 179.45 22.97 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.18 179.632 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 51.2 mt-30 -57.82 -27.12 62.88 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 120.897 0.38 . . . . 0.0 111.027 -179.124 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 69.6 m -70.41 -45.99 64.84 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.159 179.844 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -63.47 -29.28 70.59 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.119 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 84.4 t -72.51 -52.41 23.67 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.305 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.45 179.669 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 9.5 t -55.12 -43.13 73.8 Favored 'General case' 0 C--N 1.32 -0.701 0 C-N-CA 120.282 -0.567 . . . . 0.0 110.614 -179.52 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 -69.98 -49.63 49.78 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.329 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 10.7 tp-100 -59.02 -45.34 90.96 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.016 0.436 . . . . 0.0 110.652 -179.195 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -63.57 -40.36 96.77 Favored 'General case' 0 CA--C 1.502 -0.893 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.32 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 72.9 ttt180 -58.43 -43.75 88.86 Favored 'General case' 0 C--N 1.304 -1.394 0 C-N-CA 120.08 -0.648 . . . . 0.0 110.242 179.41 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 84.0 t -67.49 -53.5 31.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.169 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.102 179.798 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 189' ' ' LEU . . . . . 0.589 ' O ' ' N ' ' B' ' 193' ' ' GLY . 94.6 mt -57.73 -38.45 75.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.27 0.557 . . . . 0.0 109.741 -179.513 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 8.9 mmm180 -59.72 -44.13 93.87 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.302 179.72 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 191' ' ' ASN . . . . . 0.443 ' CB ' HD23 ' B' ' 192' ' ' LEU . 87.8 m-20 -64.42 -42.86 95.81 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.424 -0.51 . . . . 0.0 110.261 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 192' ' ' LEU . . . . . 0.443 HD23 ' CB ' ' B' ' 191' ' ' ASN . 0.4 OUTLIER -154.78 74.56 0.94 Allowed 'General case' 0 C--O 1.23 0.065 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.692 179.292 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 193' ' ' GLY . . . . . 0.589 ' N ' ' O ' ' B' ' 189' ' ' LEU . . . -148.38 0.73 0.59 Allowed Glycine 0 N--CA 1.463 0.471 0 N-CA-C 110.921 -0.872 . . . . 0.0 110.921 -179.648 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 194' ' ' LEU . . . . . 0.602 HD22 ' N ' ' B' ' 194' ' ' LEU . 3.7 mm? 56.28 60.44 3.16 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.814 0.34 . . . . 0.0 110.869 179.585 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 34.4 m -131.82 154.72 40.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.205 179.232 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 196' ' ' VAL . . . . . 0.468 HG12 ' N ' ' B' ' 197' ' ' GLY . 54.0 t -136.61 155.9 34.61 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.28 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.541 -179.379 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 197' ' ' GLY . . . . . 0.468 ' N ' HG12 ' B' ' 196' ' ' VAL . . . -145.67 158.74 27.76 Favored Glycine 0 CA--C 1.521 0.426 0 N-CA-C 110.341 -1.103 . . . . 0.0 110.341 179.718 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -113.7 114.33 26.23 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 120.941 0.4 . . . . 0.0 110.677 -179.807 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 62.4 ttp180 -86.37 134.12 33.74 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.28 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 200' ' ' ALA . . . . . . . . . . . . . . . -150.17 112.74 4.72 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.456 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 201' ' ' GLY . . . . . . . . . . . . . . . 47.57 -112.7 1.09 Allowed Glycine 0 CA--C 1.524 0.653 0 N-CA-C 110.46 -1.056 . . . . 0.0 110.46 -179.754 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 202' ' ' ARG . . . . . . . . . . . . . 20.2 mmm180 -110.13 42.59 1.51 Allowed 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 120.775 0.321 . . . . 0.0 110.415 179.668 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 41.5 t -153.15 122.53 6.69 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.566 179.842 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 1.4 tp -122.84 127.29 74.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 179.399 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 83.2 t -100.5 129.63 51.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.901 179.018 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 98.9 m-85 -105.45 130.66 53.48 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.557 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 69.9 m -150.82 171.52 17.09 Favored 'General case' 0 C--O 1.227 -0.12 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . 41.1 mt -79.04 147.44 32.84 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.535 -179.643 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 209' ' ' TYR . . . . . 0.435 ' CD2' ' CG2' ' B' ' 196' ' ' VAL . 5.9 t80 -55.66 -48.48 74.96 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.715 -0.394 . . . . 0.0 110.348 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 80.4 m-20 -124.74 -178.54 4.18 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 -179.716 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 66.6 p -104.02 -2.68 25.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.362 -179.771 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 212' ' ' HIS . . . . . 0.519 ' CE1' ' CD2' ' A' ' 104' ' ' HIS . 65.5 m80 -52.62 -54.98 25.73 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.332 -179.769 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 213' ' ' VAL . . . . . 0.509 ' HA ' HD21 ' B' ' 216' ' ' LEU . 10.6 t -44.67 -40.01 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 121.039 0.447 . . . . 0.0 110.282 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 214' ' ' ALA . . . . . . . . . . . . . . . -71.61 -36.75 70.89 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.906 179.547 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 97.5 mm-40 -64.24 -53.76 43.99 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.227 0.537 . . . . 0.0 111.223 -178.664 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 216' ' ' LEU . . . . . 0.509 HD21 ' HA ' ' B' ' 213' ' ' VAL . 3.1 pp -67.29 -40.08 86.07 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.621 -179.846 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 217' ' ' LEU . . . . . 0.453 ' HG ' HD13 ' B' ' 221' ' ' ILE . 6.3 tt -65.05 -42.33 94.35 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.467 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 218' ' ' ASP . . . . . 0.501 ' CG ' HH21 ' B' ' 162' ' ' ARG . 93.5 m-20 -61.13 -37.9 84.47 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.027 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 219' ' ' GLU . . . . . 0.424 ' OE2' ' OE2' ' A' ' 100' ' ' GLU . 97.2 mt-10 -71.79 -42.59 66.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.854 179.194 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -65.71 -49.37 68.73 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.006 0.432 . . . . 0.0 110.642 -179.747 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 221' ' ' ILE . . . . . 0.453 HD13 ' HG ' ' B' ' 217' ' ' LEU . 1.3 mp -63.99 -43.02 97.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.331 179.613 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 89.1 t80 -60.37 -48.12 83.1 Favored 'General case' 0 C--N 1.314 -0.952 0 C-N-CA 120.609 -0.437 . . . . 0.0 110.939 -179.28 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 223' ' ' HIS . . . . . 0.572 ' CD2' ' CE1' ' A' ' 93' ' ' HIS . 12.0 t-160 -67.07 -35.15 79.19 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.15 179.759 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 23.3 t -74.18 -50.29 19.9 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.952 0.406 . . . . 0.0 111.336 -179.692 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 71.9 mm-40 -66.73 -22.01 66.06 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.673 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 10.5 t60 -50.92 -69.49 0.11 Allowed 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 120.664 -0.415 . . . . 0.0 110.487 -179.221 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 227' ' ' LEU . . . . . . . . . . . . . 72.4 mt -76.78 -57.62 3.75 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.759 -179.877 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 228' ' ' HIS . . . . . . . . . . . . . 63.7 t-80 43.11 86.37 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.803 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 229' ' ' LEU . . . . . . . . . . . . . 95.1 mt -63.02 -42.82 99.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.477 -179.832 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . 76.43 3.72 78.25 Favored Glycine 0 N--CA 1.453 -0.176 0 N-CA-C 110.826 -0.909 . . . . 0.0 110.826 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 231' ' ' LEU . . . . . 0.596 HD13 ' N ' ' B' ' 232' ' ' SER . 0.2 OUTLIER -113.61 117.45 31.64 Favored 'General case' 0 N--CA 1.461 0.098 0 CA-C-O 120.807 0.336 . . . . 0.0 110.239 -179.727 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 232' ' ' SER . . . . . 0.596 ' N ' HD13 ' B' ' 231' ' ' LEU . 48.5 t -155.83 165.57 36.09 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.473 179.412 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 233' ' ' ASP . . . . . 0.434 ' O ' ' OD1' ' B' ' 233' ' ' ASP . 49.6 p-10 -90.36 89.01 7.42 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.635 179.9 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 234' ' ' ARG . . . . . . . . . . . . . 79.8 mmt-85 -78.29 148.4 33.87 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.545 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 235' ' ' HIS . . . . . . . . . . . . . 2.4 p-80 -155.25 152.42 24.9 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.592 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 236' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -67.03 -72.42 0.02 OUTLIER 'Trans proline' 0 N--CA 1.495 1.569 0 C-N-CA 122.598 2.198 . . . . 0.0 112.021 179.65 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 237' ' ' SER . . . . . . . . . . . . . 25.8 p -79.68 160.19 26.4 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.64 -179.709 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 238' ' ' ALA . . . . . . . . . . . . . . . -71.58 142.7 50.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.559 179.875 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.772 0 CA-C-O 118.031 -1.427 . . . . 0.0 110.972 179.964 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.289 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 79.2 m80 -79.61 135.87 36.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.73 0.3 . . . . 0.0 110.541 -179.888 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLY . . . . . 0.573 ' C ' ' H ' ' A' ' 6' ' ' GLU . . . 164.0 -105.19 0.25 Allowed Glycine 0 CA--C 1.517 0.219 0 N-CA-C 110.966 -0.854 . . . . 0.0 110.966 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER 69.99 -22.86 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 CA-C-O 120.781 0.324 . . . . 0.0 110.524 -179.593 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.573 ' H ' ' C ' ' A' ' 4' ' ' GLY . 97.9 mt-10 -75.46 155.48 36.21 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.764 -177.17 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 88.68 53.63 2.54 Favored Glycine 0 CA--C 1.525 0.667 0 N-CA-C 111.044 -0.822 . . . . 0.0 111.044 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 90.6 mtm-85 -63.19 -41.84 99.26 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.691 0.282 . . . . 0.0 110.532 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.433 ' O ' ' O ' ' A' ' 10' ' ' ARG . 51.5 p30 -115.86 31.59 6.62 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.552 179.823 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.433 ' O ' ' O ' ' A' ' 9' ' ' ASN . 27.5 mmt180 59.15 147.58 0.07 OUTLIER Pre-proline 0 N--CA 1.448 -0.56 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.89 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_exo -45.65 133.16 13.35 Favored 'Trans proline' 0 C--N 1.309 -1.534 0 C-N-CA 122.398 2.065 . . . . 0.0 112.248 179.642 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 98.9 p -96.87 0.0 48.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.59 179.747 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -166.64 149.34 6.09 Favored Pre-proline 0 C--N 1.324 -0.506 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.868 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -68.58 88.56 0.42 Allowed 'Trans proline' 0 C--N 1.309 -1.541 0 C-N-CA 122.569 2.179 . . . . 0.0 112.077 179.695 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 55.1 mt -62.79 -173.51 0.05 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.513 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.43 ' O ' ' HB3' ' A' ' 19' ' ' ALA . 30.8 m-20 -95.19 -31.09 13.68 Favored 'General case' 0 C--O 1.245 0.82 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.678 179.834 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 10.2 t -53.64 -57.71 9.79 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.387 -178.868 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 17.2 mp0 -44.98 -47.46 11.46 Favored 'General case' 0 C--O 1.21 -0.992 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 179.291 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.43 ' HB3' ' O ' ' A' ' 16' ' ' ASP . . . -50.58 -56.45 11.65 Favored 'General case' 0 C--O 1.242 0.664 0 C-N-CA 120.425 -0.51 . . . . 0.0 110.008 -178.49 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.17 -53.5 48.34 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.756 179.453 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -51.3 -47.64 62.53 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.778 -179.439 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 70.8 tp60 -54.48 -51.98 63.35 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-O 120.921 0.391 . . . . 0.0 110.274 -179.266 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 88.8 t -64.34 -47.53 89.22 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.53 179.779 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.04 -44.87 83.35 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.092 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 11.3 t -56.05 -42.78 77.13 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 26.3 m -60.11 -50.33 74.14 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.476 179.424 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.467 ' N ' ' CD1' ' A' ' 27' ' ' LEU . 7.2 mp -68.06 -23.21 64.93 Favored 'General case' 0 CA--C 1.522 -0.128 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.572 179.214 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.5 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 52.7 tt0 -70.89 -66.81 0.56 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.321 -179.707 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.62 -53.54 57.18 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.882 0.372 . . . . 0.0 110.438 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.503 ' O ' ' O ' ' A' ' 31' ' ' ALA . 46.3 tp -45.2 -28.41 0.77 Allowed 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.631 -179.5 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.503 ' O ' ' O ' ' A' ' 30' ' ' LEU . . . -56.22 -124.4 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.29 179.387 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.464 ' O ' ' O ' ' A' ' 31' ' ' ALA . 85.5 m 55.77 111.26 0.02 OUTLIER Pre-proline 0 C--N 1.324 -0.516 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.319 179.263 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -48.42 -47.99 18.51 Favored 'Trans proline' 0 C--N 1.305 -1.715 0 C-N-CA 122.496 2.131 . . . . 0.0 112.605 -178.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 65.1 m -62.09 -46.62 88.29 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.174 -179.058 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 53.1 ttm-85 -61.21 -45.25 95.36 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.699 -178.512 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.564 HD23 ' O ' ' A' ' 36' ' ' LEU . 1.4 tt -59.97 -52.78 63.94 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.666 -0.414 . . . . 0.0 110.343 -178.653 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 11.3 tpt -51.24 -47.79 62.29 Favored 'General case' 0 C--O 1.238 0.475 0 C-N-CA 120.63 -0.428 . . . . 0.0 110.035 -179.727 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 35.4 mm -63.34 -43.09 98.43 Favored 'Isoleucine or valine' 0 C--O 1.246 0.883 0 CA-C-O 121.101 0.477 . . . . 0.0 110.652 179.461 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.572 HD13 ' O ' ' A' ' 39' ' ' LEU . 0.2 OUTLIER -62.46 -43.7 98.19 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.758 -179.422 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 19.3 m -58.29 -40.46 82.0 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.913 179.775 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 60.7 tp60 -58.0 -45.55 86.67 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.113 179.702 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.416 HD22 ' O ' ' A' ' 87' ' ' TYR . 11.4 mt -65.42 -39.21 91.86 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.255 178.105 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 3.4 tmt_? -53.64 -46.07 70.4 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.583 -178.534 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 29.2 t-20 -61.44 -38.79 88.45 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.994 0.426 . . . . 0.0 110.226 179.307 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.401 ' O ' HD12 ' A' ' 47' ' ' LEU . . . -173.55 157.11 25.4 Favored Glycine 0 CA--C 1.527 0.8 0 N-CA-C 111.074 -0.811 . . . . 0.0 111.074 179.511 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.446 ' O ' ' O ' ' A' ' 47' ' ' LEU . 51.9 Cg_endo -71.34 -74.58 0.01 OUTLIER 'Trans proline' 0 C--N 1.31 -1.49 0 C-N-CA 122.727 2.285 . . . . 0.0 112.697 179.769 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.446 ' O ' ' O ' ' A' ' 46' ' ' PRO . 0.5 OUTLIER 59.57 144.59 0.05 OUTLIER Pre-proline 0 C--N 1.321 -0.643 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.022 178.306 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -67.54 167.28 21.25 Favored 'Trans proline' 0 C--N 1.305 -1.712 0 C-N-CA 122.554 2.169 . . . . 0.0 111.877 178.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.81 HG12 ' OE1' ' A' ' 60' ' ' GLN . 66.9 t -58.69 -41.77 83.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.131 -179.925 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.424 ' H ' HG22 ' A' ' 50' ' ' THR . 0.0 OUTLIER -60.28 -41.5 93.47 Favored 'General case' 0 C--O 1.248 0.991 0 CA-C-O 121.471 0.653 . . . . 0.0 110.69 179.78 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -64.96 -38.66 91.69 Favored 'General case' 0 C--O 1.239 0.551 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.04 179.664 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 17.9 mt -62.44 -35.23 78.63 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.342 179.641 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.495 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -60.96 -46.33 91.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.785 178.678 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 70.3 mm-40 -57.61 -47.95 80.75 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 120.484 -0.487 . . . . 0.0 110.28 179.751 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.14 -44.58 88.16 Favored 'General case' 0 C--O 1.232 0.166 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.447 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 97.4 mt -97.62 -80.05 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.461 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLY . . . . . 0.495 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 156.94 103.19 0.2 Allowed Glycine 0 CA--C 1.526 0.723 0 N-CA-C 110.767 -0.933 . . . . 0.0 110.767 -179.624 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.517 ' O ' ' NE2' ' A' ' 60' ' ' GLN . 70.2 mmm 43.3 -114.84 0.34 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.109 0.481 . . . . 0.0 110.471 179.723 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 50.33 13.17 0.11 Allowed 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.417 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.81 ' OE1' HG12 ' A' ' 49' ' ' VAL . 3.2 mm-40 -50.85 -29.59 12.21 Favored 'General case' 0 C--O 1.238 0.498 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.667 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 3.0 t -72.98 -33.88 66.11 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.298 179.569 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.5 -38.96 74.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.123 -178.583 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.458 HG23 ' N ' ' A' ' 64' ' ' SER . 12.5 m -71.06 -47.02 63.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.568 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.458 ' N ' HG23 ' A' ' 63' ' ' VAL . 11.0 t -58.16 -43.96 87.67 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 -179.7 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' HIS . . . . . 0.411 ' O ' HG23 ' A' ' 69' ' ' VAL . 86.4 t60 -64.61 -51.05 64.72 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.845 179.66 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -61.72 -39.84 92.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.6 179.771 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.3 tp -60.91 -43.56 98.38 Favored 'General case' 0 C--O 1.218 -0.596 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.038 -179.822 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 72.3 ttt180 -60.73 -42.23 96.89 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-O 120.829 0.347 . . . . 0.0 110.316 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.411 HG23 ' O ' ' A' ' 65' ' ' HIS . 85.7 t -59.97 -54.75 30.42 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 C-N-CA 120.446 -0.502 . . . . 0.0 110.132 -179.201 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.453 ' N ' HD22 ' A' ' 70' ' ' LEU . 4.3 mm? -64.12 -37.83 88.86 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.584 179.079 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 60.1 ttt85 -52.25 -41.7 63.04 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.121 -179.477 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 -56.86 -45.75 82.27 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 120.587 -0.445 . . . . 0.0 110.293 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.0 mt -67.83 -39.06 83.93 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 110.021 -0.363 . . . . 0.0 110.021 179.61 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 96.74 46.47 2.48 Favored Glycine 0 CA--C 1.52 0.364 0 N-CA-C 110.989 -0.845 . . . . 0.0 110.989 -179.569 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 5.0 tp -105.78 -9.21 17.36 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.91 0.386 . . . . 0.0 110.763 -179.8 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.9 m -135.65 160.22 39.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.508 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -153.59 174.63 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.91 -179.703 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -143.85 156.48 26.68 Favored Glycine 0 C--N 1.332 0.34 0 N-CA-C 110.825 -0.91 . . . . 0.0 110.825 179.169 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -123.89 137.13 54.69 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 120.768 0.318 . . . . 0.0 110.4 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 63.8 ttm-85 -89.25 135.28 33.66 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.509 179.914 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -151.56 133.84 15.27 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.62 179.388 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 47.45 -112.35 0.99 Allowed Glycine 0 CA--C 1.519 0.343 0 N-CA-C 110.862 -0.895 . . . . 0.0 110.862 179.717 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 84.9 mtp180 -119.56 29.73 7.45 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 120.678 0.275 . . . . 0.0 110.494 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 73.6 m -154.86 174.21 15.42 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 121.033 0.444 . . . . 0.0 110.296 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.783 HD11 ' CE2' ' A' ' 87' ' ' TYR . 1.2 pp -136.65 161.7 36.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.475 179.845 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.611 ' N ' HD12 ' A' ' 85' ' ' ILE . 3.3 m -122.86 128.51 75.24 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.767 178.747 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.783 ' CE2' HD11 ' A' ' 85' ' ' ILE . 71.7 m-85 -89.96 119.07 30.01 Favored 'General case' 0 C--O 1.22 -0.495 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.054 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 66.6 m -133.04 152.59 51.95 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-O 120.966 0.412 . . . . 0.0 110.385 -179.321 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 1.024 HD22 ' H ' ' A' ' 89' ' ' LEU . 0.5 OUTLIER -73.03 137.6 45.45 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.526 179.927 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 66.3 t80 -61.71 -50.31 72.94 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.736 -179.644 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 39.6 t0 -89.75 130.49 36.01 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.793 -179.717 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 11.8 m -93.45 -28.98 15.8 Favored 'General case' 0 C--O 1.244 0.777 0 CA-C-O 121.309 0.576 . . . . 0.0 110.389 179.345 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 75.9 m80 -55.21 -46.06 75.9 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.122 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.554 HG13 ' N ' ' A' ' 95' ' ' ALA . 13.1 p -53.05 -44.21 50.27 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.203 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.554 ' N ' HG13 ' A' ' 94' ' ' VAL . . . -57.08 -37.2 71.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.065 179.124 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -64.06 -38.93 92.87 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-O 121.23 0.538 . . . . 0.0 110.175 179.304 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 50.2 mt -61.21 -44.55 97.1 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.248 179.791 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.43 HD22 ' N ' ' A' ' 98' ' ' LEU . 4.2 mm? -66.94 -37.06 83.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.832 178.52 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -57.51 -47.26 82.43 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.189 -179.38 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.457 ' OE2' ' OE2' ' B' ' 219' ' ' GLU . 97.7 mt-10 -69.87 -52.31 25.84 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.548 179.238 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.465 ' HB2' HD13 ' B' ' 216' ' ' LEU . . . -53.3 -46.82 69.53 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.519 -179.921 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 4.8 mm -62.52 -44.53 99.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.352 -179.377 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' TYR . . . . . 0.633 ' CE1' ' NE2' ' A' ' 107' ' ' HIS . 85.1 t80 -60.84 -46.89 88.78 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.989 0.423 . . . . 0.0 110.421 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 62.7 t60 -57.0 -39.73 75.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.614 -179.82 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 36.1 t -76.28 -40.35 51.96 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.161 179.647 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -56.78 -33.96 67.15 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.408 -179.213 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' HIS . . . . . 0.633 ' NE2' ' CE1' ' A' ' 103' ' ' TYR . 9.2 m-70 -80.62 -2.21 45.54 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.513 179.66 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.447 ' C ' HD13 ' A' ' 108' ' ' LEU . 0.2 OUTLIER -144.35 103.82 4.02 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.446 179.704 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 109' ' ' HIS . . . . . 0.46 ' ND1' ' C ' ' A' ' 109' ' ' HIS . 7.2 p80 -158.65 5.01 0.11 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.647 179.531 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.531 ' N ' HD12 ' A' ' 110' ' ' LEU . 10.8 mp -63.02 -42.2 99.75 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.418 -179.355 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -75.24 -59.67 3.54 Favored Glycine 0 CA--C 1.52 0.366 0 N-CA-C 110.9 -0.88 . . . . 0.0 110.9 -179.78 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 10.6 tp 38.53 75.45 0.07 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.81 0.338 . . . . 0.0 110.748 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 40.7 t -106.0 124.22 49.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.38 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -94.7 113.99 25.86 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.534 -179.853 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.492 ' O ' ' CG ' ' A' ' 116' ' ' HIS . 30.2 mmt180 -82.06 92.52 6.83 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.388 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 116' ' ' HIS . . . . . 0.492 ' CG ' ' O ' ' A' ' 115' ' ' ARG . 53.6 m-70 -160.11 56.22 0.81 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.45 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 117' ' ' PRO . . . . . 0.41 ' CD ' ' N ' ' A' ' 116' ' ' HIS . 49.0 Cg_endo -69.16 154.79 69.57 Favored 'Trans proline' 0 C--N 1.307 -1.643 0 C-N-CA 122.696 2.264 . . . . 0.0 112.154 179.871 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 35.5 p -156.76 163.12 39.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.54 179.589 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . 56.99 46.49 19.32 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.71 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.678 0 CA-C-O 117.983 -1.454 . . . . 0.0 110.943 -179.978 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.337 0 N-CA-C 109.532 -1.427 . . . . 0.0 109.532 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 80.4 m80 -79.42 139.27 37.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.854 0.359 . . . . 0.0 110.38 179.819 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 123' ' ' GLY . . . . . 0.538 ' C ' ' H ' ' B' ' 125' ' ' GLU . . . 161.24 -108.95 0.37 Allowed Glycine 0 C--O 1.227 -0.339 0 N-CA-C 110.959 -0.857 . . . . 0.0 110.959 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER 71.15 -21.76 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.231 0.129 0 CA-C-O 120.789 0.328 . . . . 0.0 110.551 -179.63 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 125' ' ' GLU . . . . . 0.538 ' H ' ' C ' ' B' ' 123' ' ' GLY . 96.5 mt-10 -77.05 157.11 31.31 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.717 -177.264 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 85.32 53.69 3.04 Favored Glycine 0 CA--C 1.524 0.608 0 N-CA-C 110.992 -0.843 . . . . 0.0 110.992 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 127' ' ' ARG . . . . . . . . . . . . . 89.5 mtm-85 -62.63 -41.63 99.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.68 0.276 . . . . 0.0 110.524 -179.692 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 128' ' ' ASN . . . . . 0.443 ' O ' ' O ' ' B' ' 129' ' ' ARG . 52.8 p-10 -115.01 32.42 6.05 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.594 179.923 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 129' ' ' ARG . . . . . 0.443 ' O ' ' O ' ' B' ' 128' ' ' ASN . 26.7 mmt180 58.98 148.01 0.07 OUTLIER Pre-proline 0 N--CA 1.447 -0.579 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.909 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -47.16 133.98 19.04 Favored 'Trans proline' 0 C--N 1.309 -1.538 0 C-N-CA 122.416 2.077 . . . . 0.0 112.229 179.537 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 87.7 p -96.92 0.93 49.8 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.703 179.856 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 132' ' ' ALA . . . . . . . . . . . . . . . -167.02 148.86 5.48 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.966 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 133' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -68.4 85.17 0.45 Allowed 'Trans proline' 0 C--N 1.309 -1.503 0 C-N-CA 122.57 2.18 . . . . 0.0 112.016 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 47.7 mt -58.82 -173.53 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.433 179.784 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 135' ' ' ASP . . . . . 0.424 ' O ' ' HB3' ' B' ' 138' ' ' ALA . 18.3 m-20 -95.92 -30.38 13.66 Favored 'General case' 0 C--O 1.247 0.927 0 CA-C-O 121.196 0.522 . . . . 0.0 110.725 179.768 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 10.0 t -54.07 -57.18 12.05 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.379 -178.64 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 14.0 mp0 -46.01 -47.27 16.82 Favored 'General case' 0 C--O 1.209 -1.038 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 179.351 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 138' ' ' ALA . . . . . 0.424 ' HB3' ' O ' ' B' ' 135' ' ' ASP . . . -50.04 -56.25 11.55 Favored 'General case' 0 C--O 1.242 0.706 0 C-N-CA 120.423 -0.511 . . . . 0.0 109.998 -178.348 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -64.5 -53.15 52.65 Favored 'General case' 0 N--CA 1.457 -0.108 0 C-N-CA 120.381 -0.528 . . . . 0.0 110.784 179.387 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -51.44 -46.13 62.9 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.875 -179.266 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 68.9 tp60 -55.75 -52.86 62.49 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 120.862 0.363 . . . . 0.0 110.171 -179.291 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 142' ' ' VAL . . . . . . . . . . . . . 90.4 t -63.51 -46.84 94.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.451 179.651 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -57.55 -45.75 84.74 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.394 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 11.3 t -56.07 -41.72 75.55 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 19.3 m -60.64 -49.05 79.06 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.358 179.647 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 146' ' ' LEU . . . . . 0.467 ' N ' ' CD1' ' B' ' 146' ' ' LEU . 7.3 mp -69.44 -22.33 63.67 Favored 'General case' 0 CA--C 1.522 -0.122 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.572 179.172 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 147' ' ' GLN . . . . . 0.525 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 54.4 tt0 -71.58 -66.04 0.68 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.195 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -59.17 -53.64 56.06 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.833 0.349 . . . . 0.0 110.321 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.52 ' O ' ' O ' ' B' ' 150' ' ' ALA . 39.0 tp -45.8 -29.45 1.34 Allowed 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.548 -179.703 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 150' ' ' ALA . . . . . 0.525 ' HB3' ' O ' ' B' ' 147' ' ' GLN . . . -55.46 -125.54 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.36 179.535 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 151' ' ' THR . . . . . 0.463 ' O ' ' O ' ' B' ' 150' ' ' ALA . 90.9 m 56.25 112.73 0.02 OUTLIER Pre-proline 0 N--CA 1.446 -0.633 0 CA-C-N 116.508 -0.314 . . . . 0.0 110.326 179.332 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -48.56 -49.14 15.32 Favored 'Trans proline' 0 C--N 1.305 -1.731 0 C-N-CA 122.47 2.113 . . . . 0.0 112.811 -179.284 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 46.0 m -61.49 -46.64 89.15 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.043 -178.748 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 54.0 ttm-85 -61.33 -44.88 96.45 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.669 -178.541 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 155' ' ' LEU . . . . . 0.581 HD23 ' O ' ' B' ' 155' ' ' LEU . 1.8 tt -60.47 -52.63 64.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.342 -178.594 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 11.3 tpt -51.17 -47.56 62.12 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 120.607 -0.437 . . . . 0.0 109.981 -179.59 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 35.5 mm -63.52 -42.67 96.98 Favored 'Isoleucine or valine' 0 C--O 1.247 0.967 0 CA-C-O 121.123 0.487 . . . . 0.0 110.636 179.216 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 158' ' ' LEU . . . . . 0.555 HD13 ' O ' ' B' ' 158' ' ' LEU . 0.2 OUTLIER -62.57 -42.84 99.8 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.796 -179.447 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 9.2 m -59.15 -41.92 89.5 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.786 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 60.2 tp60 -56.56 -45.77 81.1 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 121.002 0.429 . . . . 0.0 110.298 179.815 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 161' ' ' LEU . . . . . 0.438 HD22 ' O ' ' B' ' 206' ' ' TYR . 12.7 mt -65.7 -38.3 88.87 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.195 178.316 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 162' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -55.29 -44.27 75.57 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.581 -178.59 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -63.69 -39.24 93.83 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.233 179.214 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 164' ' ' GLY . . . . . 0.428 ' O ' HD12 ' B' ' 166' ' ' LEU . . . -172.66 155.53 23.3 Favored Glycine 0 CA--C 1.528 0.884 0 N-CA-C 111.111 -0.796 . . . . 0.0 111.111 179.547 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 165' ' ' PRO . . . . . 0.43 ' O ' ' O ' ' B' ' 166' ' ' LEU . 49.4 Cg_endo -70.74 -75.56 0.01 OUTLIER 'Trans proline' 0 C--N 1.31 -1.453 0 C-N-CA 122.761 2.307 . . . . 0.0 112.583 179.736 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 166' ' ' LEU . . . . . 0.43 ' O ' ' O ' ' B' ' 165' ' ' PRO . 0.4 OUTLIER 60.08 144.07 0.05 OUTLIER Pre-proline 0 C--N 1.32 -0.675 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.028 178.319 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -66.6 167.14 19.81 Favored 'Trans proline' 0 C--N 1.305 -1.757 0 C-N-CA 122.58 2.186 . . . . 0.0 112.127 179.504 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 168' ' ' VAL . . . . . 0.805 HG12 ' OE1' ' B' ' 179' ' ' GLN . 55.0 t -58.24 -41.93 82.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.897 -179.923 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 169' ' ' THR . . . . . 0.438 ' H ' HG22 ' B' ' 169' ' ' THR . 0.0 OUTLIER -60.2 -41.74 93.63 Favored 'General case' 0 C--O 1.247 0.931 0 CA-C-O 121.501 0.667 . . . . 0.0 110.701 179.69 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -64.5 -38.45 91.06 Favored 'General case' 0 C--O 1.239 0.527 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.127 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 18.9 mt -62.14 -36.1 80.78 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.356 179.49 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 172' ' ' ALA . . . . . 0.474 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -60.66 -46.27 90.98 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.922 178.936 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -57.76 -48.13 80.54 Favored 'General case' 0 C--O 1.236 0.342 0 C-N-CA 120.553 -0.459 . . . . 0.0 110.285 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -65.03 -45.57 84.88 Favored 'General case' 0 C--O 1.232 0.163 0 C-N-CA 120.696 -0.402 . . . . 0.0 110.633 179.712 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 97.0 mt -96.8 -79.08 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.604 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 176' ' ' GLY . . . . . 0.474 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 156.86 103.3 0.2 Allowed Glycine 0 CA--C 1.525 0.666 0 N-CA-C 110.74 -0.944 . . . . 0.0 110.74 -179.683 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 177' ' ' MET . . . . . 0.538 ' O ' ' NE2' ' B' ' 179' ' ' GLN . 74.7 mtp 41.35 -113.16 0.18 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.181 0.515 . . . . 0.0 110.578 179.823 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 50.09 11.9 0.07 Allowed 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.305 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 179' ' ' GLN . . . . . 0.805 ' OE1' HG12 ' B' ' 168' ' ' VAL . 2.7 mm-40 -48.74 -29.33 4.37 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.752 179.778 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 38.9 m -73.04 -33.93 65.99 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.307 179.704 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -70.02 -38.87 76.02 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.119 -178.734 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 182' ' ' VAL . . . . . 0.446 HG23 ' N ' ' B' ' 183' ' ' SER . 11.0 m -71.42 -47.19 60.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.483 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 183' ' ' SER . . . . . 0.446 ' N ' HG23 ' B' ' 182' ' ' VAL . 10.5 t -57.73 -44.1 85.77 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 184' ' ' HIS . . . . . 0.409 ' O ' HG23 ' B' ' 188' ' ' VAL . 86.1 t60 -65.58 -51.71 57.68 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.809 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -60.99 -41.54 96.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.534 179.808 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 7.5 tp -59.53 -44.21 93.26 Favored 'General case' 0 C--O 1.216 -0.665 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.201 -179.668 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 72.9 ttt180 -60.09 -42.64 95.07 Favored 'General case' 0 C--O 1.242 0.671 0 CA-C-O 120.991 0.424 . . . . 0.0 110.414 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 188' ' ' VAL . . . . . 0.409 HG23 ' O ' ' B' ' 184' ' ' HIS . 88.7 t -59.46 -54.46 34.08 Favored 'Isoleucine or valine' 0 C--O 1.232 0.135 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.012 -179.211 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 189' ' ' LEU . . . . . 0.456 ' N ' ' CD2' ' B' ' 189' ' ' LEU . 4.1 mm? -64.42 -38.08 89.78 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.572 178.872 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 61.2 ttt85 -51.23 -39.72 57.25 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.321 -179.608 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -60.36 -40.1 89.56 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.809 0.337 . . . . 0.0 110.237 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 192' ' ' LEU . . . . . 0.431 HD23 ' N ' ' B' ' 192' ' ' LEU . 7.4 mt -71.59 -37.72 70.96 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.489 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 95.19 42.5 3.73 Favored Glycine 0 CA--C 1.522 0.502 0 N-CA-C 110.766 -0.934 . . . . 0.0 110.766 -179.282 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 5.1 tp -103.99 -9.55 18.77 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.794 0.33 . . . . 0.0 110.921 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 195' ' ' VAL . . . . . 0.413 ' O ' HG13 ' B' ' 196' ' ' VAL . 3.4 m -135.71 159.78 39.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.659 -179.919 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 196' ' ' VAL . . . . . 0.413 HG13 ' O ' ' B' ' 195' ' ' VAL . 0.2 OUTLIER -155.2 176.39 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.823 -179.83 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 197' ' ' GLY . . . . . . . . . . . . . . . -145.47 158.3 27.61 Favored Glycine 0 CA--C 1.52 0.397 0 N-CA-C 110.723 -0.951 . . . . 0.0 110.723 179.719 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -124.19 137.98 54.47 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-O 120.673 0.273 . . . . 0.0 110.368 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 61.6 ttm-85 -90.21 133.46 34.9 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.466 179.754 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 200' ' ' ALA . . . . . . . . . . . . . . . -149.0 134.2 18.29 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.568 179.336 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 201' ' ' GLY . . . . . . . . . . . . . . . 46.0 -113.06 0.94 Allowed Glycine 0 CA--C 1.52 0.376 0 N-CA-C 110.809 -0.916 . . . . 0.0 110.809 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 202' ' ' ARG . . . . . . . . . . . . . 84.4 mtp180 -118.76 32.69 6.0 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 120.708 0.289 . . . . 0.0 110.416 179.856 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 64.2 m -156.99 173.18 17.41 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 121.135 0.493 . . . . 0.0 110.334 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 204' ' ' ILE . . . . . 0.756 HD11 ' CE2' ' B' ' 206' ' ' TYR . 1.1 pp -136.87 160.18 36.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.352 179.787 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 205' ' ' VAL . . . . . 0.643 ' N ' HD12 ' B' ' 204' ' ' ILE . 3.0 m -120.95 129.3 75.84 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.719 178.882 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 206' ' ' TYR . . . . . 0.756 ' CE2' HD11 ' B' ' 204' ' ' ILE . 71.9 m-85 -90.37 118.33 29.78 Favored 'General case' 0 C--O 1.219 -0.533 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.005 -179.776 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 63.7 m -133.46 152.68 51.94 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.013 0.435 . . . . 0.0 110.327 -179.309 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 208' ' ' LEU . . . . . 1.031 HD22 ' H ' ' B' ' 208' ' ' LEU . 0.5 OUTLIER -73.37 136.52 44.39 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.652 179.845 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 209' ' ' TYR . . . . . 0.407 ' H ' ' HA ' ' B' ' 195' ' ' VAL . 63.4 t80 -61.68 -47.65 84.36 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.554 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -90.29 129.36 36.53 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.695 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 23.6 m -94.02 -31.06 14.39 Favored 'General case' 0 C--O 1.244 0.808 0 CA-C-O 121.334 0.587 . . . . 0.0 110.304 179.43 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 212' ' ' HIS . . . . . . . . . . . . . 75.3 m80 -54.44 -45.09 73.0 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 115.89 -0.595 . . . . 0.0 109.995 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 213' ' ' VAL . . . . . 0.569 HG13 ' N ' ' B' ' 214' ' ' ALA . 13.1 p -52.82 -43.67 46.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.054 0.454 . . . . 0.0 110.124 179.836 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 214' ' ' ALA . . . . . 0.569 ' N ' HG13 ' B' ' 213' ' ' VAL . . . -57.69 -38.12 74.64 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.014 179.053 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 57.2 tt0 -62.72 -39.5 94.26 Favored 'General case' 0 C--O 1.238 0.459 0 CA-C-O 121.258 0.551 . . . . 0.0 110.119 179.318 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 216' ' ' LEU . . . . . 0.465 HD13 ' HB2' ' A' ' 101' ' ' ALA . 48.9 mt -61.38 -44.87 96.41 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.298 179.841 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 217' ' ' LEU . . . . . 0.401 ' N ' ' CD2' ' B' ' 217' ' ' LEU . 4.1 mm? -66.45 -37.3 84.84 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.886 178.383 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -57.59 -47.36 82.32 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.14 -179.042 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 219' ' ' GLU . . . . . 0.457 ' OE2' ' OE2' ' A' ' 100' ' ' GLU . 94.6 mt-10 -69.91 -51.5 32.49 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.607 179.185 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -53.64 -47.68 70.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.459 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 4.4 mm -62.07 -44.76 99.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.432 -179.251 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 222' ' ' TYR . . . . . 0.593 ' CE1' ' NE2' ' B' ' 226' ' ' HIS . 74.5 t80 -60.09 -47.37 86.16 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.943 0.402 . . . . 0.0 110.427 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 223' ' ' HIS . . . . . . . . . . . . . 62.0 t60 -56.75 -39.24 73.64 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.586 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 32.9 t -76.74 -40.53 48.19 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.066 179.778 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 82.9 tt0 -56.78 -34.85 68.03 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.355 -179.254 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 226' ' ' HIS . . . . . 0.593 ' NE2' ' CE1' ' B' ' 222' ' ' TYR . 8.0 m-70 -80.21 -1.77 42.02 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.483 179.803 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 227' ' ' LEU . . . . . 0.481 HD22 ' HA ' ' B' ' 227' ' ' LEU . 0.2 OUTLIER -144.64 105.15 4.12 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.626 179.797 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 228' ' ' HIS . . . . . 0.455 ' C ' ' ND1' ' B' ' 228' ' ' HIS . 7.4 p80 -160.41 4.29 0.08 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.709 179.463 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 229' ' ' LEU . . . . . 0.536 ' N ' HD12 ' B' ' 229' ' ' LEU . 10.9 mp -62.09 -41.88 98.64 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.455 -179.397 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 230' ' ' GLY . . . . . 0.405 ' O ' ' C ' ' B' ' 231' ' ' LEU . . . -74.07 -57.43 4.8 Favored Glycine 0 CA--C 1.521 0.437 0 N-CA-C 110.865 -0.894 . . . . 0.0 110.865 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 231' ' ' LEU . . . . . 0.405 ' C ' ' O ' ' B' ' 230' ' ' GLY . 30.7 tp 38.08 72.35 0.13 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.802 0.334 . . . . 0.0 110.679 -179.844 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 232' ' ' SER . . . . . . . . . . . . . 31.4 t -104.1 121.66 43.69 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.916 0.389 . . . . 0.0 110.312 -179.379 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 233' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -94.44 116.96 29.41 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.535 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 234' ' ' ARG . . . . . 0.523 ' O ' ' CG ' ' B' ' 235' ' ' HIS . 30.2 mmt180 -85.2 93.7 8.72 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.47 -179.904 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 235' ' ' HIS . . . . . 0.523 ' CG ' ' O ' ' B' ' 234' ' ' ARG . 63.7 m-70 -160.81 57.18 0.84 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.528 179.836 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 236' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -70.35 155.32 64.24 Favored 'Trans proline' 0 C--N 1.307 -1.62 0 C-N-CA 122.86 2.374 . . . . 0.0 112.137 -179.888 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 237' ' ' SER . . . . . . . . . . . . . 35.7 p -156.84 164.54 37.96 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.606 179.563 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 238' ' ' ALA . . . . . . . . . . . . . . . 55.15 42.11 30.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.564 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.771 0 CA-C-O 118.012 -1.438 . . . . 0.0 110.906 179.979 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.392 0 N-CA-C 109.556 -1.418 . . . . 0.0 109.556 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.425 ' O ' ' ND1' ' A' ' 3' ' ' HIS . 10.3 p80 -155.55 148.48 24.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.83 0.348 . . . . 0.0 110.356 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 140.59 -37.41 1.68 Allowed Glycine 0 N--CA 1.462 0.431 0 N-CA-C 110.949 -0.861 . . . . 0.0 110.949 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 75.0 t -127.43 132.37 69.43 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 CA-C-O 120.925 0.393 . . . . 0.0 110.414 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 45.48 -165.94 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.472 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 79.92 22.3 64.01 Favored Glycine 0 CA--C 1.524 0.611 0 N-CA-C 111.013 -0.835 . . . . 0.0 111.013 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 37.5 mmt180 -75.65 100.24 4.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.026 0.441 . . . . 0.0 110.66 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.457 ' O ' ' O ' ' A' ' 10' ' ' ARG . 77.2 m-20 54.12 26.65 6.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.505 179.866 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.457 ' O ' ' O ' ' A' ' 9' ' ' ASN . 89.5 mtt180 56.74 151.16 0.06 OUTLIER Pre-proline 0 C--N 1.326 -0.424 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.832 179.597 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -67.41 144.76 68.86 Favored 'Trans proline' 0 N--CA 1.494 1.535 0 C-N-CA 122.511 2.141 . . . . 0.0 112.003 179.4 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.7 p -165.03 34.5 0.06 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.642 179.702 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -162.26 70.97 2.25 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.696 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -53.61 133.54 54.23 Favored 'Trans proline' 0 C--N 1.307 -1.637 0 C-N-CA 122.826 2.35 . . . . 0.0 111.772 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.527 ' O ' ' N ' ' A' ' 17' ' ' SER . 56.0 mt -85.48 174.01 9.81 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.443 179.928 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.523 ' O ' ' N ' ' A' ' 19' ' ' ALA . 98.9 m-20 -43.3 -16.82 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.722 179.76 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.527 ' N ' ' O ' ' A' ' 15' ' ' LEU . 91.3 p -38.31 -38.5 0.36 Allowed 'General case' 0 C--O 1.24 0.583 0 CA-C-O 121.231 0.539 . . . . 0.0 110.6 -179.509 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 25.1 pt20 -65.33 -44.02 89.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.328 179.144 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.544 ' O ' HG23 ' A' ' 23' ' ' VAL . . . -63.67 -28.6 70.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.202 179.456 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.36 -51.73 48.64 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.239 179.68 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.06 -46.5 89.36 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.71 179.821 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -54.48 -50.58 67.42 Favored 'General case' 0 C--O 1.241 0.648 0 CA-C-O 121.177 0.513 . . . . 0.0 110.471 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.544 HG23 ' O ' ' A' ' 19' ' ' ALA . 92.2 t -62.76 -44.73 99.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.42 179.573 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.554 ' HB1' ' N ' ' B' ' 151' ' ' THR . . . -53.6 -44.05 69.11 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 10.9 t -59.91 -43.88 94.6 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 11.1 m -63.73 -46.95 83.06 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.025 0.441 . . . . 0.0 110.39 179.289 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 95.4 mt -67.26 -21.12 65.73 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.643 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 58.2 tt0 -75.81 -56.36 4.75 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.637 179.329 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.12 -54.61 45.02 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.448 -179.466 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.486 ' O ' ' O ' ' A' ' 31' ' ' ALA . 93.3 mt -47.56 -41.96 22.56 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.557 -179.205 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.517 ' O ' ' CB ' ' A' ' 32' ' ' THR . . . -50.04 -174.97 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.017 179.752 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.544 ' N ' ' HB1' ' B' ' 143' ' ' ALA . 1.0 OUTLIER 88.37 118.3 0.03 OUTLIER Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.031 179.961 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -46.7 -46.58 17.69 Favored 'Trans proline' 0 N--CA 1.496 1.659 0 C-N-CA 122.368 2.045 . . . . 0.0 113.113 -178.662 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 11.6 t -58.97 -44.5 91.55 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.813 -179.118 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 22.5 mmt85 -62.0 -46.15 90.46 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 120.675 -0.41 . . . . 0.0 110.984 -179.315 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.467 ' CD2' ' O ' ' A' ' 30' ' ' LEU . 4.2 mm? -62.87 -47.31 83.88 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.974 -179.567 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.5 ' SD ' HD11 ' A' ' 56' ' ' ILE . 14.3 tmm? -58.32 -49.22 77.97 Favored 'General case' 0 C--N 1.32 -0.677 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.545 -179.673 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 32.9 mm -63.96 -44.62 97.96 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.789 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 49.3 mt -62.12 -42.35 99.14 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.754 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 19.5 m -60.16 -41.32 92.56 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.2 -0.455 . . . . 0.0 109.896 179.554 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.539 ' N ' ' OE1' ' A' ' 41' ' ' GLN . 0.1 OUTLIER -57.85 -49.68 75.86 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.262 -0.426 . . . . 0.0 109.928 179.992 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 98.3 mt -63.77 -42.55 97.76 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.455 -0.498 . . . . 0.0 110.685 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 72.7 ttp85 -71.53 -21.12 61.95 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.646 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 62.0 t-20 -62.46 -41.22 98.61 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.934 0.397 . . . . 0.0 110.48 -179.541 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 159.34 -166.59 34.78 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 111.088 -0.805 . . . . 0.0 111.088 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_exo -73.51 115.51 4.36 Favored 'Trans proline' 0 N--CA 1.492 1.415 0 C-N-CA 122.888 2.392 . . . . 0.0 112.151 179.82 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.449 ' O ' ' O ' ' A' ' 48' ' ' PRO . 0.3 OUTLIER -158.34 84.61 2.58 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.106 179.911 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 48' ' ' PRO . . . . . 0.449 ' O ' ' O ' ' A' ' 47' ' ' LEU . 51.2 Cg_exo -51.14 -166.57 0.0 OUTLIER 'Trans proline' 0 C--N 1.303 -1.855 0 C-N-CA 122.471 2.114 . . . . 0.0 112.385 179.699 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 55.0 t -59.69 -51.06 77.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 121.072 0.463 . . . . 0.0 111.291 -179.265 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.423 HG22 ' H ' ' A' ' 50' ' ' THR . 0.1 OUTLIER -57.33 -44.84 84.57 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.257 0.551 . . . . 0.0 109.921 179.957 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 -65.09 -33.99 77.34 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.592 -0.522 . . . . 0.0 109.592 179.429 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.591 ' O ' HD13 ' A' ' 52' ' ' LEU . 0.2 OUTLIER -62.05 -43.26 99.21 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 120.541 -0.463 . . . . 0.0 110.09 -179.777 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.81 -45.04 96.01 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.587 179.407 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 41.1 tp10 -65.03 -30.42 71.4 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.369 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -70.28 -53.98 14.56 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.853 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.5 HD11 ' SD ' ' A' ' 37' ' ' MET . 90.2 mt -94.26 -68.67 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.247 179.858 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 134.2 97.72 0.6 Allowed Glycine 0 C--N 1.332 0.322 0 N-CA-C 111.348 -0.701 . . . . 0.0 111.348 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 65.6 mtt 60.02 97.38 0.03 OUTLIER 'General case' 0 CA--C 1.519 -0.212 0 C-N-CA 120.819 -0.352 . . . . 0.0 110.928 178.928 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -179.6 19.15 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.488 179.875 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 56.0 mt-30 -54.4 -26.72 32.16 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.365 0.602 . . . . 0.0 110.797 -179.047 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 78.1 p -74.39 -31.48 62.36 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.237 179.353 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -74.6 -38.98 62.46 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.446 -178.802 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.599 HG13 ' N ' ' A' ' 64' ' ' SER . 7.6 p -73.81 -50.63 28.21 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 CA-C-N 116.515 -0.312 . . . . 0.0 110.381 179.898 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.599 ' N ' HG13 ' A' ' 63' ' ' VAL . 45.4 t -58.37 -43.76 88.58 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 120.509 -0.477 . . . . 0.0 110.362 -179.787 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' HIS . . . . . 0.472 ' O ' HG23 ' A' ' 69' ' ' VAL . 55.6 t-80 -67.0 -45.55 77.24 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.859 179.686 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -63.86 -48.49 76.51 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.974 -179.192 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -61.84 -44.55 96.62 Favored 'General case' 0 CA--C 1.503 -0.829 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.877 -179.343 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 60.8 ttp180 -59.55 -44.35 93.27 Favored 'General case' 0 C--N 1.315 -0.891 0 CA-C-O 121.059 0.457 . . . . 0.0 110.377 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.472 HG23 ' O ' ' A' ' 65' ' ' HIS . 47.9 t -59.24 -51.83 67.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 C-N-CA 120.344 -0.542 . . . . 0.0 110.055 -179.85 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 95.6 mt -67.9 -27.68 66.85 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.976 0.417 . . . . 0.0 110.467 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 74.2 ttt180 -62.31 -42.43 99.36 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.408 -179.695 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 -60.56 -44.52 96.08 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 120.599 -0.441 . . . . 0.0 110.357 -179.672 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 10.2 mt -65.3 -39.01 91.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.318 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 99.4 60.05 0.87 Allowed Glycine 0 N--CA 1.462 0.403 0 N-CA-C 110.717 -0.953 . . . . 0.0 110.717 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 27.9 tp -118.53 -15.91 9.55 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 121.006 0.431 . . . . 0.0 110.352 -179.801 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 21.2 m -131.37 163.64 36.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.087 0.47 . . . . 0.0 110.281 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.582 HG12 ' N ' ' A' ' 78' ' ' GLY . 91.9 t -143.62 163.22 15.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.803 -179.481 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.582 ' N ' HG12 ' A' ' 77' ' ' VAL . . . -108.56 161.24 13.35 Favored Glycine 0 CA--C 1.524 0.597 0 N-CA-C 110.584 -1.006 . . . . 0.0 110.584 179.606 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -142.02 111.25 6.41 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.761 0.315 . . . . 0.0 110.568 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 73.8 ttp85 -75.07 128.43 35.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.587 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.434 ' O ' ' O ' ' A' ' 84' ' ' SER . . . -171.56 142.99 1.69 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.588 179.816 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 53.06 46.88 61.25 Favored Glycine 0 CA--C 1.525 0.665 0 N-CA-C 110.966 -0.854 . . . . 0.0 110.966 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 83.6 mtp180 50.42 29.29 3.81 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.77 0.319 . . . . 0.0 110.75 -179.735 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' SER . . . . . 0.434 ' O ' ' O ' ' A' ' 81' ' ' ALA . 29.8 t -153.03 139.96 19.14 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-O 121.023 0.44 . . . . 0.0 110.09 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.766 HD11 ' CE2' ' A' ' 87' ' ' TYR . 1.2 pp -92.69 148.01 4.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.293 179.901 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 70.2 t -122.38 134.23 66.23 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.26 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.064 179.809 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.766 ' CE2' HD11 ' A' ' 85' ' ' ILE . 64.4 m-85 -90.93 124.6 35.33 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.387 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 65.5 m -138.67 158.79 43.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.516 -179.598 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 18.2 mt -66.88 140.47 57.79 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.315 -179.563 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.405 ' CD1' ' C ' ' A' ' 90' ' ' TYR . 14.5 t80 -57.12 -50.7 71.98 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.642 -179.76 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -100.98 134.27 44.22 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.879 0.371 . . . . 0.0 110.608 -179.486 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 70.8 p -74.26 -26.66 60.34 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.363 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 74.0 m80 -56.36 -43.69 79.38 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.338 -179.772 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 75.0 t -56.94 -43.06 79.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -179.706 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.37 -43.03 99.57 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.252 179.497 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 68.1 tp60 -64.34 -42.59 96.18 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.177 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 12.6 tp -59.02 -43.66 91.61 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.964 -179.373 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 90.4 mt -64.34 -39.71 94.44 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.191 179.444 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -58.92 -42.39 89.56 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.437 -179.743 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -66.16 -53.71 34.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.514 179.811 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.95 -41.06 86.54 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.021 0.438 . . . . 0.0 110.49 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 4.0 mm -61.63 -44.58 98.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.519 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' TYR . . . . . 0.508 ' O ' ' ND1' ' A' ' 107' ' ' HIS . 4.0 m-85 -66.21 -38.29 87.61 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.139 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 3.8 t60 -58.64 -42.81 89.19 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.589 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 29.8 t -79.45 -36.61 38.58 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.036 0.446 . . . . 0.0 111.22 179.386 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 48.1 tp10 -55.68 -40.77 72.76 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.433 -178.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' HIS . . . . . 0.508 ' ND1' ' O ' ' A' ' 103' ' ' TYR . 36.0 m80 -49.85 -70.43 0.09 Allowed 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 -179.196 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.52 HD23 ' N ' ' A' ' 109' ' ' HIS . 1.8 tt -177.93 112.93 0.08 Allowed 'General case' 0 C--N 1.328 -0.362 0 O-C-N 123.336 0.397 . . . . 0.0 110.404 179.383 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 109' ' ' HIS . . . . . 0.52 ' N ' HD23 ' A' ' 108' ' ' LEU . 47.4 t-80 -156.49 100.71 1.97 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.7 179.527 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 95.4 mt -63.29 -41.79 99.01 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.433 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 45.7 76.36 0.13 Allowed Glycine 0 CA--C 1.52 0.363 0 N-CA-C 111.058 -0.817 . . . . 0.0 111.058 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 44.5 tp -79.93 127.25 32.04 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.851 -0.34 . . . . 0.0 110.485 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 9.8 p -74.99 147.57 40.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.686 179.568 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 91.5 m-20 -98.47 1.02 46.31 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.536 179.705 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 95.7 mtt-85 -65.6 -101.77 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.674 -179.737 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 11.3 m-70 43.63 71.6 1.42 Allowed Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.515 -179.852 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -58.9 144.85 98.65 Favored 'Trans proline' 0 C--N 1.306 -1.666 0 C-N-CA 122.724 2.283 . . . . 0.0 111.805 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 65.7 m -116.96 121.82 42.49 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.638 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -70.22 143.46 52.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.372 179.774 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.703 0 CA-C-O 118.031 -1.427 . . . . 0.0 110.991 -179.932 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.233 0 N-CA-C 109.46 -1.456 . . . . 0.0 109.46 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 13.6 p80 -151.48 150.91 30.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.801 0.334 . . . . 0.0 110.331 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 123' ' ' GLY . . . . . . . . . . . . . . . 139.09 -35.54 1.97 Allowed Glycine 0 CA--C 1.521 0.453 0 N-CA-C 110.934 -0.867 . . . . 0.0 110.934 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 124' ' ' VAL . . . . . 0.418 ' O ' ' O ' ' B' ' 125' ' ' GLU . 79.5 t -128.37 134.56 64.56 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 CA-C-O 120.903 0.382 . . . . 0.0 110.381 -179.802 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 125' ' ' GLU . . . . . 0.418 ' O ' ' O ' ' B' ' 124' ' ' VAL . 97.3 mt-10 42.9 -166.57 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.618 179.704 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 80.64 21.4 64.06 Favored Glycine 0 CA--C 1.524 0.648 0 N-CA-C 110.936 -0.866 . . . . 0.0 110.936 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 127' ' ' ARG . . . . . . . . . . . . . 35.9 mmt180 -73.38 100.7 3.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.84 0.353 . . . . 0.0 110.719 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 128' ' ' ASN . . . . . 0.478 ' O ' ' O ' ' B' ' 129' ' ' ARG . 82.9 m-20 53.94 27.31 7.17 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.607 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 129' ' ' ARG . . . . . 0.478 ' O ' ' O ' ' B' ' 128' ' ' ASN . 86.3 mtt180 56.01 150.63 0.06 OUTLIER Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.982 179.751 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo -67.06 144.92 71.59 Favored 'Trans proline' 0 C--N 1.307 -1.609 0 C-N-CA 122.511 2.141 . . . . 0.0 112.04 179.438 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 59.5 p -164.04 28.28 0.08 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.677 179.618 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 132' ' ' ALA . . . . . . . . . . . . . . . -157.18 74.03 4.41 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.771 -179.75 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 133' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_exo -55.32 137.1 76.35 Favored 'Trans proline' 0 C--N 1.307 -1.651 0 C-N-CA 122.829 2.353 . . . . 0.0 111.659 179.756 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 134' ' ' LEU . . . . . 0.534 ' O ' ' N ' ' B' ' 136' ' ' SER . 55.2 mt -88.81 174.55 7.91 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.393 179.773 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 135' ' ' ASP . . . . . 0.503 ' O ' ' N ' ' B' ' 138' ' ' ALA . 94.4 m-20 -42.89 -17.08 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.624 179.68 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 136' ' ' SER . . . . . 0.534 ' N ' ' O ' ' B' ' 134' ' ' LEU . 69.3 p -38.35 -38.65 0.38 Allowed 'General case' 0 C--O 1.239 0.512 0 CA-C-O 121.285 0.564 . . . . 0.0 110.423 -179.577 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 137' ' ' GLN . . . . . 0.419 ' CG ' ' N ' ' B' ' 138' ' ' ALA . 23.5 pt20 -65.9 -45.18 82.93 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.398 179.174 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 138' ' ' ALA . . . . . 0.516 ' O ' HG23 ' B' ' 142' ' ' VAL . . . -63.18 -28.16 69.86 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.163 179.708 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.28 -50.82 51.13 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.28 179.703 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -60.33 -46.32 90.3 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.534 179.724 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -54.39 -51.32 65.21 Favored 'General case' 0 C--O 1.241 0.646 0 CA-C-O 121.27 0.557 . . . . 0.0 110.544 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 142' ' ' VAL . . . . . 0.516 HG23 ' O ' ' B' ' 138' ' ' ALA . 90.5 t -62.7 -45.88 97.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.451 179.686 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 143' ' ' ALA . . . . . 0.544 ' HB1' ' N ' ' A' ' 32' ' ' THR . . . -52.05 -44.58 64.32 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 36.7 t -59.43 -44.44 92.9 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.039 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 8.1 m -63.68 -47.06 82.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.485 179.511 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 93.6 mt -66.53 -20.69 66.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.621 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 147' ' ' GLN . . . . . 0.416 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 58.8 tt0 -75.78 -56.85 4.29 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.585 179.287 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -57.93 -54.71 43.83 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.362 -179.424 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.483 ' O ' ' O ' ' B' ' 150' ' ' ALA . 94.2 mt -46.93 -41.7 16.49 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.359 -179.245 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 150' ' ' ALA . . . . . 0.519 ' O ' ' CB ' ' B' ' 151' ' ' THR . . . -50.6 -174.33 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.147 -0.479 . . . . 0.0 109.978 179.651 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 151' ' ' THR . . . . . 0.554 ' N ' ' HB1' ' A' ' 24' ' ' ALA . 1.0 OUTLIER 88.14 117.84 0.03 OUTLIER Pre-proline 0 CA--C 1.538 0.518 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 179.833 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -46.74 -46.47 18.03 Favored 'Trans proline' 0 N--CA 1.495 1.586 0 C-N-CA 122.322 2.015 . . . . 0.0 113.063 -178.518 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 48.1 t -58.97 -44.42 91.53 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.969 -179.253 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 20.7 mmt85 -61.78 -45.91 91.84 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.739 -0.385 . . . . 0.0 111.042 -179.463 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 155' ' ' LEU . . . . . 0.461 ' CD2' ' O ' ' B' ' 149' ' ' LEU . 4.2 mm? -62.76 -47.71 82.35 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 120.598 -0.441 . . . . 0.0 111.073 -179.853 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 156' ' ' MET . . . . . 0.527 ' SD ' HD11 ' B' ' 175' ' ' ILE . 14.4 tmm? -58.29 -49.24 77.84 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 120.337 -0.545 . . . . 0.0 110.612 -179.859 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 5.9 mm -64.4 -44.91 97.16 Favored 'Isoleucine or valine' 0 C--O 1.239 0.507 0 CA-C-O 121.098 0.475 . . . . 0.0 110.823 -179.504 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 57.7 mt -62.09 -41.77 98.53 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.599 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 28.0 m -59.75 -41.9 92.02 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.179 -0.464 . . . . 0.0 109.815 179.292 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 160' ' ' GLN . . . . . 0.55 ' OE1' ' N ' ' B' ' 160' ' ' GLN . 0.0 OUTLIER -58.02 -49.24 77.55 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.854 -0.425 . . . . 0.0 109.854 179.958 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 161' ' ' LEU . . . . . . . . . . . . . 97.5 mt -63.95 -42.75 97.21 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 120.373 -0.531 . . . . 0.0 110.573 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 162' ' ' ARG . . . . . . . . . . . . . 72.5 ttp85 -71.3 -21.0 62.13 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.51 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 59.4 t-20 -63.18 -41.87 99.27 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.579 -179.53 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . 162.26 -165.44 36.01 Favored Glycine 0 CA--C 1.528 0.853 0 N-CA-C 111.017 -0.833 . . . . 0.0 111.017 -179.828 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -79.06 112.98 3.15 Favored 'Trans proline' 0 C--N 1.31 -1.486 0 C-N-CA 122.958 2.439 . . . . 0.0 111.769 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 166' ' ' LEU . . . . . 0.436 ' O ' ' O ' ' B' ' 167' ' ' PRO . 0.3 OUTLIER -153.35 85.86 4.11 Favored Pre-proline 0 C--N 1.325 -0.486 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.264 -178.935 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 167' ' ' PRO . . . . . 0.436 ' O ' ' O ' ' B' ' 166' ' ' LEU . 51.4 Cg_exo -50.69 -167.94 0.0 OUTLIER 'Trans proline' 0 C--N 1.306 -1.692 0 C-N-CA 122.607 2.205 . . . . 0.0 112.243 179.76 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . 80.0 t -59.59 -50.41 80.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.973 -179.209 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 169' ' ' THR . . . . . 0.43 ' H ' HG22 ' B' ' 169' ' ' THR . 0.0 OUTLIER -57.54 -44.77 85.44 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.281 0.562 . . . . 0.0 109.976 -179.835 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 -65.51 -34.69 78.85 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.632 179.657 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 171' ' ' LEU . . . . . 0.603 ' O ' HD13 ' B' ' 171' ' ' LEU . 0.2 OUTLIER -61.62 -44.47 96.92 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 120.466 -0.493 . . . . 0.0 110.02 -179.614 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 172' ' ' ALA . . . . . . . . . . . . . . . -60.39 -44.33 95.78 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 179.397 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 45.3 tp10 -64.89 -30.65 71.66 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.388 179.736 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -69.92 -54.46 13.3 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.846 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 175' ' ' ILE . . . . . 0.527 HD11 ' SD ' ' B' ' 156' ' ' MET . 93.1 mt -93.56 -68.18 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.293 179.848 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . 133.46 96.75 0.6 Allowed Glycine 0 C--N 1.332 0.333 0 N-CA-C 111.317 -0.713 . . . . 0.0 111.317 -179.887 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 61.6 mtt 61.91 96.68 0.03 OUTLIER 'General case' 0 CA--C 1.52 -0.19 0 CA-C-O 120.713 0.292 . . . . 0.0 110.765 178.631 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -178.93 19.02 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.58 179.577 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 56.0 mt-30 -54.23 -27.24 33.36 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.36 0.6 . . . . 0.0 110.848 -179.059 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 78.5 p -74.41 -32.71 62.77 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.394 179.546 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -73.29 -38.75 65.77 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.584 -178.741 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 182' ' ' VAL . . . . . 0.583 HG13 ' N ' ' B' ' 183' ' ' SER . 7.3 p -73.42 -49.73 35.04 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.509 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.436 179.975 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 183' ' ' SER . . . . . 0.583 ' N ' HG13 ' B' ' 182' ' ' VAL . 43.0 t -58.09 -43.77 87.26 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 120.706 -0.397 . . . . 0.0 110.129 -179.533 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 184' ' ' HIS . . . . . 0.495 ' O ' HG23 ' B' ' 188' ' ' VAL . 54.7 t-80 -67.16 -45.01 78.29 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.618 179.687 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -63.65 -49.76 71.97 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.708 -179.411 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -61.31 -44.27 97.48 Favored 'General case' 0 CA--C 1.502 -0.888 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.789 -179.532 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 60.5 ttp180 -59.62 -44.9 93.28 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.143 0.497 . . . . 0.0 110.469 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 188' ' ' VAL . . . . . 0.495 HG23 ' O ' ' B' ' 184' ' ' HIS . 44.2 t -58.93 -52.17 63.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.196 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 86.1 mt -67.82 -28.38 67.52 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.938 0.399 . . . . 0.0 110.361 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 74.9 ttt180 -61.52 -42.34 98.67 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.412 -179.701 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -60.49 -45.36 94.04 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.71 -0.396 . . . . 0.0 110.437 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 192' ' ' LEU . . . . . . . . . . . . . 10.0 mt -65.03 -40.13 94.38 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.315 179.776 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 101.0 53.85 1.0 Allowed Glycine 0 N--CA 1.462 0.412 0 N-CA-C 111.005 -0.838 . . . . 0.0 111.005 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 14.9 tp -111.94 -15.06 13.4 Favored 'General case' 0 N--CA 1.462 0.125 0 CA-C-O 120.885 0.374 . . . . 0.0 110.618 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 23.9 m -132.13 163.76 36.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 121.015 0.436 . . . . 0.0 110.349 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 196' ' ' VAL . . . . . 0.598 HG12 ' N ' ' B' ' 197' ' ' GLY . 96.4 t -144.33 163.42 14.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.686 -179.6 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 197' ' ' GLY . . . . . 0.598 ' N ' HG12 ' B' ' 196' ' ' VAL . . . -109.21 160.04 13.74 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.534 -1.026 . . . . 0.0 110.534 179.598 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -140.82 110.92 6.6 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.738 0.304 . . . . 0.0 110.734 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 73.3 ttp85 -73.62 128.28 35.08 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.462 179.679 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 200' ' ' ALA . . . . . 0.435 ' O ' ' O ' ' B' ' 203' ' ' SER . . . -171.65 139.71 1.25 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.513 179.769 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 201' ' ' GLY . . . . . . . . . . . . . . . 55.37 48.78 67.51 Favored Glycine 0 CA--C 1.525 0.7 0 N-CA-C 110.878 -0.889 . . . . 0.0 110.878 179.801 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 202' ' ' ARG . . . . . . . . . . . . . 84.4 mtp180 49.04 26.96 1.53 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.631 0.253 . . . . 0.0 110.563 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 203' ' ' SER . . . . . 0.435 ' O ' ' O ' ' B' ' 200' ' ' ALA . 33.1 t -150.26 139.75 21.49 Favored 'General case' 0 CA--C 1.52 -0.187 0 CA-C-O 121.116 0.484 . . . . 0.0 110.179 179.915 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 204' ' ' ILE . . . . . 0.703 HD11 ' CE2' ' B' ' 206' ' ' TYR . 1.3 pp -93.14 146.73 6.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.287 179.773 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 69.8 t -120.89 134.87 62.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.085 179.799 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 206' ' ' TYR . . . . . 0.703 ' CE2' HD11 ' B' ' 204' ' ' ILE . 59.0 m-85 -91.8 125.12 36.39 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.512 179.877 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 67.8 m -139.26 158.53 43.99 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.502 -179.549 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . 15.9 mt -66.91 138.91 57.64 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.457 -179.693 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 15.2 t80 -54.77 -51.99 64.0 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.674 -179.772 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 63.8 m-20 -99.85 135.36 41.39 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.827 0.346 . . . . 0.0 110.673 -179.396 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 76.2 p -75.74 -24.26 56.09 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.374 179.709 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 212' ' ' HIS . . . . . . . . . . . . . 74.3 m80 -57.32 -43.48 83.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.289 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 74.5 t -57.67 -43.58 83.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 214' ' ' ALA . . . . . . . . . . . . . . . -59.7 -45.61 91.59 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.366 179.478 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 69.5 tp60 -63.63 -41.94 98.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.265 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 216' ' ' LEU . . . . . . . . . . . . . 14.6 tp -59.05 -43.93 91.73 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.025 -179.283 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 82.1 mt -64.51 -39.41 93.73 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.099 179.526 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -58.82 -42.3 88.89 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.514 -179.778 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 219' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -67.14 -51.43 54.04 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.534 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -59.77 -41.48 91.18 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.062 0.458 . . . . 0.0 110.406 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 4.4 mm -61.78 -44.04 98.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.674 -179.714 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 222' ' ' TYR . . . . . 0.432 ' O ' ' ND1' ' B' ' 226' ' ' HIS . 4.2 m-85 -66.36 -38.53 87.79 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.271 179.936 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 223' ' ' HIS . . . . . . . . . . . . . 3.3 t60 -58.48 -43.08 88.86 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.526 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 37.5 t -77.89 -36.27 49.81 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.9 179.494 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 225' ' ' GLU . . . . . 0.504 ' C ' ' H ' ' B' ' 227' ' ' LEU . 37.0 tp10 -59.86 -30.94 69.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.529 -179.276 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 226' ' ' HIS . . . . . 0.555 ' O ' ' CB ' ' B' ' 227' ' ' LEU . 27.3 m80 -62.55 4.21 0.17 Allowed 'General case' 0 CA--C 1.507 -0.704 0 CA-C-O 118.681 -0.676 . . . . 0.0 111.264 -179.707 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 227' ' ' LEU . . . . . 0.579 ' C ' HD23 ' B' ' 227' ' ' LEU . 3.6 tt 96.29 110.67 0.02 OUTLIER 'General case' 0 C--N 1.344 0.361 0 O-C-N 124.589 1.181 . . . . 0.0 110.84 179.834 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 228' ' ' HIS . . . . . 0.536 ' N ' HD23 ' B' ' 227' ' ' LEU . 84.5 t60 -152.12 104.04 2.93 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.497 179.26 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 229' ' ' LEU . . . . . . . . . . . . . 82.5 mt -62.4 -42.97 99.84 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.31 -179.124 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . 42.06 74.11 0.19 Allowed Glycine 0 CA--C 1.524 0.652 0 N-CA-C 110.935 -0.866 . . . . 0.0 110.935 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 231' ' ' LEU . . . . . . . . . . . . . 52.6 tp -76.01 129.81 37.44 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.615 -179.672 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 232' ' ' SER . . . . . . . . . . . . . 10.4 p -77.03 151.11 35.7 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.536 179.342 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 233' ' ' ASP . . . . . . . . . . . . . 91.4 m-20 -100.56 1.25 40.72 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.573 179.8 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 234' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -64.81 -101.91 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.663 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 235' ' ' HIS . . . . . . . . . . . . . 11.4 m-70 43.52 71.54 1.43 Allowed Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.571 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 236' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -59.76 143.09 99.69 Favored 'Trans proline' 0 C--N 1.306 -1.696 0 C-N-CA 122.692 2.261 . . . . 0.0 111.736 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 237' ' ' SER . . . . . . . . . . . . . 66.7 m -115.32 121.5 43.04 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.468 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 238' ' ' ALA . . . . . . . . . . . . . . . -70.31 143.44 52.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.544 179.875 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.761 0 CA-C-O 118.098 -1.39 . . . . 0.0 110.882 -179.992 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.262 0 N-CA-C 109.512 -1.435 . . . . 0.0 109.512 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -84.65 127.57 34.15 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.811 0.338 . . . . 0.0 110.504 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -88.54 93.43 1.89 Allowed Glycine 0 CA--C 1.526 0.725 0 N-CA-C 110.939 -0.865 . . . . 0.0 110.939 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 19.1 m -73.22 -24.66 20.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 120.898 0.38 . . . . 0.0 110.665 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 17.2 pt-20 -67.41 149.14 50.65 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.648 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -151.87 -101.14 0.21 Allowed Glycine 0 CA--C 1.523 0.581 0 N-CA-C 110.877 -0.889 . . . . 0.0 110.877 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 41.5 ttm180 44.89 90.45 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.695 0.284 . . . . 0.0 110.491 -179.878 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.5 ' CG ' ' H ' ' A' ' 10' ' ' ARG . 59.3 t30 -141.67 -144.59 0.16 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.417 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.5 ' H ' ' CG ' ' A' ' 9' ' ' ASN . 64.1 mtm180 55.87 57.93 9.85 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.604 -179.75 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -71.63 146.99 50.37 Favored 'Trans proline' 0 C--N 1.31 -1.493 0 C-N-CA 122.677 2.251 . . . . 0.0 112.1 -179.901 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.425 ' O ' ' HB2' ' A' ' 13' ' ' ALA . 44.9 t -161.36 124.28 3.15 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.186 179.579 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.562 ' HB3' ' HD3' ' A' ' 14' ' ' PRO . . . 175.37 -45.96 0.0 OUTLIER Pre-proline 0 CA--C 1.533 0.326 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.482 -179.541 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.562 ' HD3' ' HB3' ' A' ' 13' ' ' ALA . 52.2 Cg_exo -52.79 -162.13 0.0 OUTLIER 'Trans proline' 0 C--N 1.313 -1.333 0 C-N-CA 122.498 2.132 . . . . 0.0 112.18 -178.712 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.527 ' O ' ' N ' ' A' ' 17' ' ' SER . 70.2 mt -66.39 153.94 41.43 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.153 -179.869 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.525 ' O ' ' N ' ' A' ' 19' ' ' ALA . 99.2 m-20 -43.33 -16.96 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.63 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.527 ' N ' ' O ' ' A' ' 15' ' ' LEU . 86.4 p -38.46 -40.16 0.53 Allowed 'General case' 0 C--O 1.236 0.368 0 CA-C-O 121.239 0.542 . . . . 0.0 110.473 -179.788 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 94.8 mm-40 -65.49 -42.93 91.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.191 179.235 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.525 ' N ' ' O ' ' A' ' 16' ' ' ASP . . . -65.79 -28.77 69.26 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.501 179.407 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.61 -52.84 27.13 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.376 179.718 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.8 -49.58 76.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.914 0.387 . . . . 0.0 111.153 179.563 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 66.5 tp60 -53.62 -50.11 66.39 Favored 'General case' 0 C--O 1.242 0.682 0 CA-C-O 121.722 0.772 . . . . 0.0 109.996 -179.559 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.424 HG23 ' O ' ' A' ' 19' ' ' ALA . 57.7 t -62.59 -41.76 93.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.639 -0.709 . . . . 0.0 109.689 179.517 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.462 ' HB2' HD12 ' B' ' 155' ' ' LEU . . . -50.68 -47.43 58.81 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.176 179.785 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 40.3 t -60.22 -43.84 95.67 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.318 -0.401 . . . . 0.0 109.982 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 24.2 m -63.24 -51.77 64.87 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.253 -0.579 . . . . 0.0 110.934 179.72 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 88.6 mt -67.76 -21.1 65.28 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.761 -179.603 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.428 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 52.7 tt0 -75.05 -60.56 2.24 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.759 179.467 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.494 ' HB1' ' NH1' ' A' ' 35' ' ' ARG . . . -58.33 -53.04 62.74 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.863 -179.063 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.432 ' O ' ' C ' ' A' ' 31' ' ' ALA . 4.0 mm? -51.23 -41.37 60.27 Favored 'General case' 0 CA--C 1.509 -0.634 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 -178.475 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.563 ' O ' ' C ' ' A' ' 32' ' ' THR . . . -39.22 -70.81 0.09 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.431 179.757 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.563 ' C ' ' O ' ' A' ' 31' ' ' ALA . 7.1 p -3.35 107.16 0.03 OUTLIER Pre-proline 0 N--CA 1.48 1.027 0 O-C-N 124.583 1.177 . . . . 0.0 111.018 -179.685 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -47.3 -48.47 15.0 Favored 'Trans proline' 0 C--N 1.307 -1.611 0 C-N-CA 122.073 1.849 . . . . 0.0 113.31 -177.635 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 11.1 t -57.62 -44.14 85.28 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.659 -179.297 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.494 ' NH1' ' HB1' ' A' ' 29' ' ' ALA . 38.5 ttm180 -61.18 -45.24 95.43 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 120.643 -0.423 . . . . 0.0 110.71 -179.886 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.548 ' O ' HG23 ' A' ' 40' ' ' THR . 80.3 mt -57.69 -52.28 66.09 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.313 -0.555 . . . . 0.0 110.707 -179.761 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.43 ' O ' ' OG1' ' A' ' 40' ' ' THR . 53.9 ttp -53.63 -46.23 70.42 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.221 -0.592 . . . . 0.0 110.583 179.412 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.603 HD12 HE22 ' A' ' 66' ' ' GLN . 97.5 mt -62.36 -48.03 90.26 Favored 'Isoleucine or valine' 0 C--O 1.239 0.529 0 CA-C-O 121.332 0.587 . . . . 0.0 110.798 -179.572 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -61.89 -41.56 98.03 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.575 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.548 HG23 ' O ' ' A' ' 36' ' ' LEU . 37.4 p -61.77 -33.98 75.06 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.988 179.956 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 60.8 tp60 -64.47 -50.49 67.27 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 120.603 -0.439 . . . . 0.0 109.897 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 16.6 mt -62.86 -30.45 71.52 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.495 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 10.8 ttm180 -42.58 -41.29 2.99 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.586 -179.512 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 95.1 m-20 -62.36 -42.92 99.78 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.981 0.42 . . . . 0.0 110.186 -179.747 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 162.23 178.32 36.01 Favored Glycine 0 CA--C 1.527 0.8 0 C-N-CA 120.559 -0.829 . . . . 0.0 111.361 179.027 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 15.1 Cg_exo -67.33 148.07 79.21 Favored 'Trans proline' 0 N--CA 1.49 1.28 0 C-N-CA 122.85 2.367 . . . . 0.0 111.899 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.569 HD12 ' O ' ' A' ' 47' ' ' LEU . 0.3 OUTLIER -164.43 159.4 15.86 Favored Pre-proline 0 CA--C 1.536 0.414 0 C-N-CA 120.262 -0.575 . . . . 0.0 110.793 178.734 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_exo -66.79 149.33 83.48 Favored 'Trans proline' 0 N--CA 1.496 1.629 0 C-N-CA 122.589 2.193 . . . . 0.0 112.292 178.792 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.46 HG23 ' N ' ' A' ' 50' ' ' THR . 5.0 m -64.57 -39.73 86.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.815 0.817 . . . . 0.0 110.695 179.193 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.46 ' N ' HG23 ' A' ' 49' ' ' VAL . 8.5 m -56.34 -66.08 0.5 Allowed 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 114.738 -1.119 . . . . 0.0 110.548 179.316 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -50.43 -39.24 46.97 Favored 'General case' 0 C--O 1.24 0.559 0 CA-C-O 121.441 0.639 . . . . 0.0 109.645 -179.204 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.57 HD23 ' O ' ' A' ' 52' ' ' LEU . 1.4 tt -59.55 -42.17 91.77 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.859 -0.61 . . . . 0.0 109.433 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.533 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -65.0 -42.87 94.11 Favored 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 120.863 -0.335 . . . . 0.0 110.135 179.591 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 83.6 tt0 -53.62 -34.23 57.79 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 179.901 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -72.13 -38.87 69.17 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.582 178.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 96.8 mt -88.41 -68.95 0.62 Allowed 'Isoleucine or valine' 0 CA--C 1.521 -0.173 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.244 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLY . . . . . 0.533 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 148.94 71.25 0.01 OUTLIER Glycine 0 CA--C 1.521 0.451 0 N-CA-C 111.682 -0.567 . . . . 0.0 111.682 179.617 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 4.1 mmt 57.83 79.15 0.21 Allowed 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 120.779 0.323 . . . . 0.0 110.641 179.35 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 86.4 mt-10 -150.91 19.93 0.78 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.729 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -61.77 -30.64 70.93 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.411 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 36.0 t -65.26 -42.94 92.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.524 -179.8 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.53 -30.88 71.62 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.082 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 89.8 t -70.49 -49.91 49.39 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.209 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.566 179.436 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 38.8 t -57.06 -42.56 80.79 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 120.892 0.377 . . . . 0.0 110.249 -179.787 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 43.5 t60 -60.91 -50.6 72.76 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-O 121.259 0.552 . . . . 0.0 110.499 179.777 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.603 HE22 HD12 ' A' ' 38' ' ' ILE . 37.0 mt-30 -62.32 -34.54 76.82 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.069 179.646 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.483 HD21 HH21 ' A' ' 71' ' ' ARG . 2.4 tp -62.91 -43.68 98.14 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.223 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 95.5 mtt-85 -62.57 -41.56 99.0 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 120.849 0.356 . . . . 0.0 110.186 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 86.2 t -63.1 -53.84 41.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.199 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 12.5 mt -61.13 -40.85 95.35 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.027 0.441 . . . . 0.0 110.048 -179.485 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.483 HH21 HD21 ' A' ' 67' ' ' LEU . 62.2 ttm-85 -54.83 -41.01 70.16 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.941 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 -60.14 -48.18 82.81 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 120.396 -0.522 . . . . 0.0 110.495 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.4 mt -66.87 -41.47 87.21 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.936 0.398 . . . . 0.0 110.555 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 100.41 88.99 2.02 Favored Glycine 0 CA--C 1.52 0.389 0 N-CA-C 110.947 -0.861 . . . . 0.0 110.947 -179.775 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 5.1 tp -152.2 -14.17 0.18 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.749 0.309 . . . . 0.0 110.853 179.834 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.434 ' HA ' ' H ' ' A' ' 90' ' ' TYR . 28.1 m -134.96 158.64 41.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.066 -179.701 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.681 HG12 ' N ' ' A' ' 78' ' ' GLY . 59.4 t -124.07 170.98 13.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.276 -179.635 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.681 ' N ' HG12 ' A' ' 77' ' ' VAL . . . -158.53 149.13 19.17 Favored Glycine 0 CA--C 1.526 0.733 0 N-CA-C 110.604 -0.998 . . . . 0.0 110.604 179.386 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 62.7 t0 -124.7 123.46 40.07 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 120.905 0.383 . . . . 0.0 110.447 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 94.9 mtt-85 -73.79 153.47 39.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.54 -179.772 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -165.38 97.43 0.69 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.636 -179.822 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 64.11 -124.15 29.55 Favored Glycine 0 CA--C 1.524 0.624 0 N-CA-C 110.831 -0.908 . . . . 0.0 110.831 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 34.9 ptt180 -96.79 13.13 29.61 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.47 0.176 . . . . 0.0 110.797 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 24.7 m -141.68 163.8 31.93 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-O 121.084 0.468 . . . . 0.0 109.903 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.977 HD11 ' CE2' ' A' ' 87' ' ' TYR . 0.8 OUTLIER -141.94 162.81 19.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.225 179.907 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.763 ' N ' HD12 ' A' ' 85' ' ' ILE . 52.2 t -113.19 138.42 42.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.977 ' CE2' HD11 ' A' ' 85' ' ' ILE . 0.2 OUTLIER -112.25 136.06 52.15 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.063 -179.815 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 1.9 m -150.92 171.66 16.9 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.805 -0.442 . . . . 0.0 109.805 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 34.0 mt -84.28 143.31 29.63 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.616 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.434 ' H ' ' HA ' ' A' ' 76' ' ' VAL . 77.5 t80 -60.42 -45.67 92.79 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.689 179.665 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 35.7 p30 -141.98 171.5 13.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.507 -179.893 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' THR . . . . . 0.486 ' O ' ' HB3' ' A' ' 95' ' ' ALA . 54.9 p -96.83 -7.23 34.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.564 -179.854 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' HIS . . . . . 0.626 ' CG ' ' CD2' ' B' ' 223' ' ' HIS . 61.4 m80 -41.85 -61.45 1.11 Allowed 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.033 0.444 . . . . 0.0 110.637 179.734 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 69.1 t -53.88 -41.04 47.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.788 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.486 ' HB3' ' O ' ' A' ' 92' ' ' THR . . . -56.84 -43.51 81.17 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.346 179.79 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 90.6 mt-30 -62.27 -45.4 93.46 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 121.153 0.502 . . . . 0.0 110.132 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 13.6 tp -56.84 -44.38 82.04 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.007 -179.332 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 92.9 mt -64.13 -37.12 86.3 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.01 179.546 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 46.3 t0 -56.47 -45.62 80.8 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.107 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.463 ' OE2' ' OE2' ' B' ' 219' ' ' GLU . 91.7 mt-10 -67.52 -52.09 43.16 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.604 179.382 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -52.74 -46.39 67.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.057 179.782 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 5.2 mm -63.39 -44.25 98.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 121.132 0.491 . . . . 0.0 110.71 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -60.65 -46.19 91.26 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.254 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' HIS . . . . . 0.645 ' CD2' ' CG ' ' B' ' 212' ' ' HIS . 18.8 t-80 -65.29 -36.81 85.21 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.465 179.733 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 47.2 t -59.48 -46.59 88.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.333 -179.772 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 77.9 tt0 -74.7 -60.55 2.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.075 0.464 . . . . 0.0 110.807 179.333 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 85.6 t60 -50.14 -28.62 7.65 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.913 -179.574 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.435 ' C ' HD13 ' A' ' 108' ' ' LEU . 0.2 OUTLIER -110.83 89.11 2.95 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.489 179.748 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 49.7 t-80 -152.55 14.42 0.57 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.708 179.522 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 88.4 mt -62.67 -43.0 99.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.606 -179.741 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 70.87 -177.01 35.49 Favored Glycine 0 CA--C 1.523 0.567 0 N-CA-C 110.692 -0.963 . . . . 0.0 110.692 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -144.12 73.27 1.38 Allowed 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 110.218 -0.29 . . . . 0.0 110.218 179.919 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.477 ' O ' ' O ' ' A' ' 114' ' ' ASP . 83.1 p 39.89 -153.18 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.514 179.771 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 114' ' ' ASP . . . . . 0.477 ' O ' ' O ' ' A' ' 113' ' ' SER . 98.5 m-20 57.38 137.2 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.057 0.456 . . . . 0.0 110.725 179.847 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 6.7 ptp180 -141.23 150.33 42.52 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.57 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' HIS . . . . . 0.449 ' CG ' ' O ' ' A' ' 116' ' ' HIS . 5.3 p80 -167.37 72.9 1.0 Allowed Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.407 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -52.58 -38.85 76.2 Favored 'Trans proline' 0 C--N 1.307 -1.653 0 C-N-CA 122.828 2.352 . . . . 0.0 112.106 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 64.8 m -130.71 152.47 50.03 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.544 -179.629 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -63.75 -37.96 89.32 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.497 -179.795 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.693 0 CA-C-O 118.068 -1.407 . . . . 0.0 110.938 -179.962 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.321 0 N-CA-C 109.526 -1.429 . . . . 0.0 109.526 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 98.8 m-70 -97.76 126.15 42.96 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.8 0.333 . . . . 0.0 110.451 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 123' ' ' GLY . . . . . . . . . . . . . . . -86.27 94.29 1.93 Allowed Glycine 0 CA--C 1.524 0.629 0 N-CA-C 110.979 -0.849 . . . . 0.0 110.979 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 16.6 m -75.59 -21.89 16.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.004 0.43 . . . . 0.0 110.683 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 125' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -69.54 150.2 47.39 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.614 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -152.16 -103.91 0.25 Allowed Glycine 0 CA--C 1.524 0.616 0 N-CA-C 110.873 -0.891 . . . . 0.0 110.873 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 127' ' ' ARG . . . . . . . . . . . . . 41.8 ttm180 47.29 87.55 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.648 0.261 . . . . 0.0 110.45 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 128' ' ' ASN . . . . . 0.518 ' CG ' ' H ' ' B' ' 129' ' ' ARG . 60.1 t30 -139.0 -146.07 0.2 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.32 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 129' ' ' ARG . . . . . 0.518 ' H ' ' CG ' ' B' ' 128' ' ' ASN . 69.0 mtm180 56.56 59.42 8.37 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.532 -179.76 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -72.49 148.86 48.89 Favored 'Trans proline' 0 C--N 1.311 -1.44 0 C-N-CA 122.757 2.305 . . . . 0.0 112.136 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 131' ' ' SER . . . . . 0.468 ' O ' ' HB2' ' B' ' 132' ' ' ALA . 42.6 t -163.09 126.12 2.73 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.233 179.632 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 132' ' ' ALA . . . . . 0.57 ' N ' ' CD ' ' B' ' 133' ' ' PRO . . . 172.86 -44.71 0.0 OUTLIER Pre-proline 0 CA--C 1.534 0.34 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.436 -179.477 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 133' ' ' PRO . . . . . 0.57 ' CD ' ' N ' ' B' ' 132' ' ' ALA . 51.5 Cg_exo -54.08 -162.98 0.01 OUTLIER 'Trans proline' 0 C--N 1.313 -1.296 0 C-N-CA 122.549 2.166 . . . . 0.0 112.04 -178.812 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 134' ' ' LEU . . . . . 0.53 ' O ' ' N ' ' B' ' 136' ' ' SER . 63.5 mt -66.01 153.56 41.85 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.218 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 135' ' ' ASP . . . . . 0.52 ' O ' ' N ' ' B' ' 138' ' ' ALA . 97.9 m-20 -43.08 -17.11 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.631 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 136' ' ' SER . . . . . 0.53 ' N ' ' O ' ' B' ' 134' ' ' LEU . 92.8 p -38.43 -40.08 0.52 Allowed 'General case' 0 C--O 1.236 0.352 0 CA-C-O 121.27 0.557 . . . . 0.0 110.403 -179.71 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 95.9 mm-40 -65.66 -43.27 89.91 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.172 179.175 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 138' ' ' ALA . . . . . 0.52 ' N ' ' O ' ' B' ' 135' ' ' ASP . . . -64.81 -29.1 70.05 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.489 179.44 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.83 -52.43 30.02 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.338 179.734 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -60.47 -50.14 74.76 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.929 0.395 . . . . 0.0 111.172 179.592 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 68.1 tp60 -53.92 -49.55 68.4 Favored 'General case' 0 C--O 1.243 0.72 0 CA-C-O 121.591 0.71 . . . . 0.0 110.019 -179.576 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 142' ' ' VAL . . . . . 0.432 HG23 ' O ' ' B' ' 138' ' ' ALA . 53.4 t -62.21 -42.71 96.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.784 179.38 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 143' ' ' ALA . . . . . 0.438 ' HB2' HD12 ' A' ' 36' ' ' LEU . . . -50.24 -46.76 55.07 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.011 179.648 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 11.3 t -59.99 -44.51 94.48 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.155 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 19.8 m -63.75 -51.36 65.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.265 0.555 . . . . 0.0 111.049 179.909 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 92.5 mt -67.75 -21.1 65.29 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.909 -179.572 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 147' ' ' GLN . . . . . 0.41 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 53.2 tt0 -75.34 -59.37 2.77 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.728 179.417 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 148' ' ' ALA . . . . . 0.486 ' HB1' ' NH1' ' B' ' 154' ' ' ARG . . . -59.02 -53.69 55.56 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.049 -179.159 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.441 ' O ' ' C ' ' B' ' 150' ' ' ALA . 4.0 mm? -50.86 -41.95 58.37 Favored 'General case' 0 CA--C 1.509 -0.599 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 -178.304 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 150' ' ' ALA . . . . . 0.553 ' O ' ' C ' ' B' ' 151' ' ' THR . . . -38.91 -72.18 0.07 Allowed 'General case' 0 CA--C 1.511 -0.555 0 O-C-N 123.519 0.512 . . . . 0.0 110.334 179.719 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 151' ' ' THR . . . . . 0.553 ' C ' ' O ' ' B' ' 150' ' ' ALA . 6.5 p -1.77 105.74 0.02 OUTLIER Pre-proline 0 N--CA 1.478 0.948 0 O-C-N 124.428 1.08 . . . . 0.0 111.088 -179.839 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo -46.32 -48.73 12.77 Favored 'Trans proline' 0 C--N 1.307 -1.648 0 C-N-CA 122.053 1.836 . . . . 0.0 113.154 -177.574 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 11.3 t -57.2 -43.99 83.22 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.722 -179.214 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 154' ' ' ARG . . . . . 0.486 ' NH1' ' HB1' ' B' ' 148' ' ' ALA . 38.7 ttm180 -62.42 -43.86 97.82 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.592 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 155' ' ' LEU . . . . . 0.518 ' O ' HG23 ' B' ' 159' ' ' THR . 31.5 mt -58.4 -51.5 69.57 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.424 -0.511 . . . . 0.0 110.718 -179.561 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 156' ' ' MET . . . . . 0.401 ' O ' ' OG1' ' B' ' 159' ' ' THR . 51.9 ttp -55.44 -45.65 76.81 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 120.267 -0.573 . . . . 0.0 110.596 179.727 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 97.0 mt -62.65 -47.4 93.08 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 CA-C-O 121.378 0.609 . . . . 0.0 110.87 -179.514 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -62.53 -41.31 98.79 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.602 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 159' ' ' THR . . . . . 0.518 HG23 ' O ' ' B' ' 155' ' ' LEU . 31.3 p -62.47 -32.77 73.71 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.064 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 59.2 tp60 -64.93 -50.17 67.51 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.223 -0.444 . . . . 0.0 109.949 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 161' ' ' LEU . . . . . 0.429 ' O ' ' N ' ' B' ' 164' ' ' GLY . 17.0 mt -62.49 -31.75 72.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.584 179.776 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 162' ' ' ARG . . . . . . . . . . . . . 11.2 ttm180 -40.82 -41.47 1.58 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.618 -179.625 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -62.33 -42.25 99.23 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.316 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 164' ' ' GLY . . . . . 0.429 ' N ' ' O ' ' B' ' 161' ' ' LEU . . . 161.03 178.58 35.13 Favored Glycine 0 CA--C 1.527 0.785 0 C-N-CA 120.672 -0.775 . . . . 0.0 111.331 179.086 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_exo -67.74 147.94 76.44 Favored 'Trans proline' 0 N--CA 1.49 1.272 0 C-N-CA 122.836 2.357 . . . . 0.0 112.028 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 166' ' ' LEU . . . . . 0.577 ' O ' HD12 ' B' ' 166' ' ' LEU . 0.3 OUTLIER -163.76 160.61 17.36 Favored Pre-proline 0 CA--C 1.534 0.359 0 C-N-CA 120.133 -0.627 . . . . 0.0 110.701 178.717 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 16.1 Cg_exo -68.22 149.33 75.98 Favored 'Trans proline' 0 N--CA 1.495 1.583 0 C-N-CA 122.525 2.15 . . . . 0.0 112.119 178.821 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 168' ' ' VAL . . . . . 0.456 HG23 ' N ' ' B' ' 169' ' ' THR . 4.5 m -64.54 -40.0 87.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 121.819 0.818 . . . . 0.0 110.728 179.143 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 169' ' ' THR . . . . . 0.456 ' N ' HG23 ' B' ' 168' ' ' VAL . 7.0 m -55.87 -66.5 0.41 Allowed 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 114.702 -1.135 . . . . 0.0 110.496 179.381 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 93.2 m-20 -50.35 -39.91 47.65 Favored 'General case' 0 C--O 1.239 0.546 0 CA-C-O 121.326 0.584 . . . . 0.0 109.687 -179.341 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 171' ' ' LEU . . . . . 0.596 HD23 ' O ' ' B' ' 171' ' ' LEU . 1.5 tt -58.99 -42.5 90.18 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.379 -0.601 . . . . 0.0 109.379 -179.838 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 172' ' ' ALA . . . . . 0.539 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -64.37 -42.63 96.08 Favored 'General case' 0 N--CA 1.446 -0.675 0 C-N-CA 120.826 -0.35 . . . . 0.0 110.18 179.575 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -53.92 -34.51 59.78 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.099 -0.5 . . . . 0.0 109.695 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -71.97 -38.22 69.77 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.574 178.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 96.7 mt -88.55 -69.43 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.519 -0.246 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.296 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 176' ' ' GLY . . . . . 0.539 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 148.98 70.43 0.01 OUTLIER Glycine 0 CA--C 1.522 0.5 0 N-CA-C 111.518 -0.633 . . . . 0.0 111.518 179.654 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 3.9 mmt 58.71 78.46 0.25 Allowed 'General case' 0 N--CA 1.462 0.148 0 CA-C-O 120.782 0.325 . . . . 0.0 110.807 179.282 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 86.3 mt-10 -150.55 20.15 0.82 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.8 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -61.69 -29.96 70.43 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.056 0.455 . . . . 0.0 110.29 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 6.9 t -65.57 -43.38 89.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.529 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -62.31 -30.81 71.41 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.177 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 83.9 t -71.0 -50.36 43.17 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.185 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.591 179.497 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 42.9 t -57.37 -41.74 80.74 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.928 0.394 . . . . 0.0 110.336 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 19.5 t60 -61.64 -51.0 70.27 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.212 0.53 . . . . 0.0 110.51 179.835 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 36.4 mt-30 -62.65 -32.81 73.92 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.015 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 186' ' ' LEU . . . . . 0.436 HD21 HH21 ' B' ' 190' ' ' ARG . 2.7 tp -63.27 -44.12 96.02 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.1 179.876 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -62.63 -41.88 99.28 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 120.729 -0.388 . . . . 0.0 110.31 -179.803 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 98.1 t -62.58 -54.13 38.0 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 C-N-CA 119.974 -0.69 . . . . 0.0 110.351 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 12.6 mt -60.73 -40.35 92.01 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.08 0.466 . . . . 0.0 110.049 -179.479 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 190' ' ' ARG . . . . . 0.436 HH21 HD21 ' B' ' 186' ' ' LEU . 62.7 ttm-85 -55.15 -41.68 72.12 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.025 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 92.1 m-20 -59.69 -46.82 87.92 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.439 -0.504 . . . . 0.0 110.281 -179.623 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 192' ' ' LEU . . . . . . . . . . . . . 9.7 mt -67.11 -39.75 86.74 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.953 0.406 . . . . 0.0 110.417 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 97.54 88.79 1.88 Allowed Glycine 0 N--CA 1.463 0.474 0 N-CA-C 110.765 -0.934 . . . . 0.0 110.765 -179.651 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 4.7 tp -152.45 -13.64 0.17 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.802 0.334 . . . . 0.0 110.859 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 195' ' ' VAL . . . . . 0.429 ' HA ' ' H ' ' B' ' 209' ' ' TYR . 27.7 m -135.02 158.64 41.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 109.832 -0.432 . . . . 0.0 109.832 -179.697 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 196' ' ' VAL . . . . . 0.665 HG12 ' N ' ' B' ' 197' ' ' GLY . 64.7 t -121.8 169.02 13.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.323 -179.688 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 197' ' ' GLY . . . . . 0.665 ' N ' HG12 ' B' ' 196' ' ' VAL . . . -157.33 142.04 8.31 Favored Glycine 0 CA--C 1.525 0.665 0 N-CA-C 110.615 -0.994 . . . . 0.0 110.615 179.471 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 60.4 t0 -119.63 125.26 48.3 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 120.935 0.398 . . . . 0.0 110.559 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 94.1 mtt-85 -75.03 152.56 38.68 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.572 -179.871 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 200' ' ' ALA . . . . . . . . . . . . . . . -164.69 99.32 0.79 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.523 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 201' ' ' GLY . . . . . . . . . . . . . . . 60.82 -125.31 37.95 Favored Glycine 0 CA--C 1.522 0.506 0 N-CA-C 110.752 -0.939 . . . . 0.0 110.752 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 202' ' ' ARG . . . . . . . . . . . . . 35.1 ptt180 -96.68 21.05 9.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.546 0.212 . . . . 0.0 110.667 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 30.9 m -150.18 162.98 39.39 Favored 'General case' 0 CA--C 1.517 -0.299 0 N-CA-C 109.722 -0.474 . . . . 0.0 109.722 -179.667 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 204' ' ' ILE . . . . . 0.963 HD11 ' CE2' ' B' ' 206' ' ' TYR . 0.8 OUTLIER -141.72 162.24 20.64 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.187 -179.967 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 205' ' ' VAL . . . . . 0.744 ' N ' HD12 ' B' ' 204' ' ' ILE . 55.6 t -112.79 134.79 54.26 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 179.546 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 206' ' ' TYR . . . . . 0.963 ' CE2' HD11 ' B' ' 204' ' ' ILE . 0.2 OUTLIER -108.43 135.9 48.94 Favored 'General case' 0 N--CA 1.469 0.485 0 O-C-N 123.58 0.55 . . . . 0.0 109.987 -179.834 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 3.1 m -150.63 171.16 17.57 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 -179.834 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . 29.5 mt -83.77 143.13 30.19 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.623 -179.812 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 209' ' ' TYR . . . . . 0.442 ' HA ' HG23 ' B' ' 196' ' ' VAL . 81.0 t80 -60.69 -46.02 91.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.71 179.77 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 43.2 p30 -140.84 172.56 12.52 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.338 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 211' ' ' THR . . . . . 0.472 ' O ' ' HB3' ' B' ' 214' ' ' ALA . 43.5 p -98.37 -7.65 28.42 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.439 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 212' ' ' HIS . . . . . 0.645 ' CG ' ' CD2' ' A' ' 104' ' ' HIS . 60.5 m80 -41.7 -61.33 1.11 Allowed 'General case' 0 C--O 1.233 0.224 0 CA-C-O 120.96 0.41 . . . . 0.0 110.419 179.779 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 92.0 t -53.88 -41.64 49.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.181 -0.463 . . . . 0.0 109.771 -179.743 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 214' ' ' ALA . . . . . 0.472 ' HB3' ' O ' ' B' ' 211' ' ' THR . . . -56.44 -43.37 79.43 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.368 179.814 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 84.3 mt-30 -62.38 -45.26 93.97 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.072 -179.813 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 216' ' ' LEU . . . . . . . . . . . . . 12.6 tp -56.61 -44.38 81.1 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.509 -0.477 . . . . 0.0 109.898 -179.326 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 92.5 mt -63.8 -38.23 90.32 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.093 179.522 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 58.0 t0 -56.05 -45.84 79.09 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.08 -179.71 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 219' ' ' GLU . . . . . 0.463 ' OE2' ' OE2' ' A' ' 100' ' ' GLU . 93.6 mt-10 -67.66 -51.79 45.67 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.708 -0.397 . . . . 0.0 110.62 179.462 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -53.09 -46.32 68.59 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 179.861 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 4.8 mm -63.73 -44.08 98.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 121.084 0.469 . . . . 0.0 110.613 -179.746 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 84.5 t80 -60.58 -45.76 92.76 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.017 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 223' ' ' HIS . . . . . 0.626 ' CD2' ' CG ' ' A' ' 93' ' ' HIS . 19.0 t-80 -65.55 -37.01 85.47 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.534 179.641 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 11.5 t -59.12 -46.73 87.58 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.339 -179.719 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -74.58 -59.8 2.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.09 0.472 . . . . 0.0 110.663 179.348 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 86.1 t60 -50.51 -30.31 12.62 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.877 -179.576 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 227' ' ' LEU . . . . . 0.426 ' CB ' ' O ' ' B' ' 223' ' ' HIS . 0.2 OUTLIER -108.94 87.77 2.57 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.564 179.76 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 228' ' ' HIS . . . . . 0.495 ' ND1' ' O ' ' B' ' 228' ' ' HIS . 56.3 t-80 -151.66 15.66 0.68 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.687 179.538 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 229' ' ' LEU . . . . . . . . . . . . . 84.9 mt -63.47 -43.39 97.46 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.836 -179.741 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . 71.44 -177.23 37.09 Favored Glycine 0 CA--C 1.525 0.696 0 N-CA-C 110.664 -0.975 . . . . 0.0 110.664 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 231' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -144.8 72.34 1.33 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.713 0.292 . . . . 0.0 110.311 -179.882 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 232' ' ' SER . . . . . 0.482 ' O ' ' O ' ' B' ' 233' ' ' ASP . 85.8 p 40.63 -153.19 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.597 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 233' ' ' ASP . . . . . 0.482 ' O ' ' O ' ' B' ' 232' ' ' SER . 97.8 m-20 57.26 138.37 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.182 0.515 . . . . 0.0 110.708 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 234' ' ' ARG . . . . . . . . . . . . . 7.1 ptp180 -142.23 151.24 41.91 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.565 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 235' ' ' HIS . . . . . 0.427 ' O ' ' CG ' ' B' ' 235' ' ' HIS . 4.9 p80 -168.74 73.66 0.79 Allowed Pre-proline 0 C--N 1.328 -0.349 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.474 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 236' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -53.47 -38.7 83.41 Favored 'Trans proline' 0 C--N 1.308 -1.571 0 C-N-CA 122.821 2.347 . . . . 0.0 112.103 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 237' ' ' SER . . . . . . . . . . . . . 73.2 m -129.68 152.79 48.8 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.468 -179.616 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 238' ' ' ALA . . . . . . . . . . . . . . . -63.48 -36.16 82.85 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.452 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.219 -0.827 0 CA-C-O 118.023 -1.432 . . . . 0.0 110.978 179.973 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.23 0 N-CA-C 109.596 -1.402 . . . . 0.0 109.596 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 99.1 m-70 45.97 79.49 0.05 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.794 0.33 . . . . 0.0 110.636 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -62.47 -42.02 99.73 Favored Glycine 0 CA--C 1.522 0.491 0 N-CA-C 110.855 -0.898 . . . . 0.0 110.855 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 35.6 m -137.96 160.56 33.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.872 0.368 . . . . 0.0 110.442 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -138.38 144.76 40.4 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.62 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 78.63 0.48 80.11 Favored Glycine 0 CA--C 1.52 0.352 0 N-CA-C 110.968 -0.853 . . . . 0.0 110.968 179.767 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 14.4 tpt180 -145.1 120.07 10.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.798 0.332 . . . . 0.0 110.571 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -153.82 126.04 7.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.689 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 67.1 ttt180 54.07 68.87 2.46 Favored Pre-proline 0 C--N 1.326 -0.421 0 CA-C-O 121.153 0.502 . . . . 0.0 110.643 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.426 ' O ' ' O ' ' A' ' 12' ' ' SER . 22.2 Cg_exo -63.83 146.86 92.24 Favored 'Trans proline' 0 C--N 1.306 -1.707 0 C-N-CA 122.854 2.369 . . . . 0.0 112.098 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.426 ' O ' ' O ' ' A' ' 11' ' ' PRO . 46.1 m 45.68 97.3 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.689 179.154 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.693 ' HB3' ' HD3' ' A' ' 14' ' ' PRO . . . -175.65 -61.9 0.0 OUTLIER Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.201 -179.495 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.693 ' HD3' ' HB3' ' A' ' 13' ' ' ALA . 25.1 Cg_endo -60.68 -31.3 91.88 Favored 'Trans proline' 0 C--N 1.31 -1.474 0 C-N-CA 122.619 2.213 . . . . 0.0 111.908 -179.757 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.563 ' O ' ' N ' ' A' ' 17' ' ' SER . 59.2 mt -106.58 86.0 2.26 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.25 -179.55 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 95.4 m-20 -37.17 -24.28 0.01 OUTLIER 'General case' 0 CA--C 1.528 0.111 0 O-C-N 123.45 0.469 . . . . 0.0 110.737 179.713 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.563 ' N ' ' O ' ' A' ' 15' ' ' LEU . 12.4 t -45.02 -48.17 11.6 Favored 'General case' 0 C--O 1.239 0.549 0 CA-C-O 121.164 0.507 . . . . 0.0 110.142 179.488 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 9.4 mp0 -64.53 -45.53 86.75 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.125 -0.488 . . . . 0.0 109.895 179.461 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.643 ' O ' HG23 ' A' ' 23' ' ' VAL . . . -56.14 -28.4 57.85 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.189 -0.46 . . . . 0.0 109.872 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.475 ' HB1' ' HB3' ' B' ' 155' ' ' LEU . . . -71.98 -49.54 36.4 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 110.108 -0.33 . . . . 0.0 110.108 179.429 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.03 -44.96 96.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.354 -179.803 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -60.96 -51.62 68.5 Favored 'General case' 0 C--O 1.242 0.671 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.701 -179.507 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.643 HG23 ' O ' ' A' ' 19' ' ' ALA . 98.8 t -60.49 -44.28 96.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.967 179.744 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.69 -42.14 78.56 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 120.804 -0.358 . . . . 0.0 110.201 179.525 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.2 m -59.2 -43.86 92.23 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.309 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.475 ' OG1' ' O ' ' A' ' 23' ' ' VAL . 30.6 p -64.83 -52.24 57.78 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 120.833 -0.347 . . . . 0.0 110.635 179.872 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.414 ' N ' ' CD1' ' A' ' 27' ' ' LEU . 7.6 mp -63.17 -21.58 66.3 Favored 'General case' 0 C--O 1.223 -0.295 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.787 179.493 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.553 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 64.0 tt0 -74.31 -59.91 2.51 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.688 179.391 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.62 -54.63 44.88 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.518 -179.478 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.505 ' O ' ' O ' ' A' ' 31' ' ' ALA . 8.5 mp -47.79 -32.42 5.99 Favored 'General case' 0 CA--C 1.515 -0.393 0 C-N-CA 120.956 -0.298 . . . . 0.0 110.387 -179.947 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.553 ' HB3' ' O ' ' A' ' 28' ' ' GLN . . . -56.84 -139.04 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.459 0 O-C-N 123.51 0.506 . . . . 0.0 110.247 179.711 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.485 ' O ' ' O ' ' A' ' 31' ' ' ALA . 7.1 m 56.54 117.35 0.01 OUTLIER Pre-proline 0 C--N 1.32 -0.695 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.347 179.659 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -48.37 -47.83 18.89 Favored 'Trans proline' 0 C--N 1.308 -1.561 0 C-N-CA 122.311 2.008 . . . . 0.0 112.824 -178.85 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 77.8 p -58.15 -48.71 79.42 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.977 -178.467 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.1 mmp_? -68.15 -36.58 79.9 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.584 179.893 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.518 HD13 ' O ' ' A' ' 36' ' ' LEU . 0.2 OUTLIER -61.34 -53.45 56.55 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.468 -0.493 . . . . 0.0 110.687 -178.367 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.453 ' C ' ' SD ' ' A' ' 37' ' ' MET . 0.9 OUTLIER -60.73 -45.77 93.0 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.473 179.967 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 86.8 mt -61.18 -43.56 96.62 Favored 'Isoleucine or valine' 0 C--O 1.242 0.66 0 CA-C-O 121.258 0.552 . . . . 0.0 110.394 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 34.5 mt -62.06 -40.59 96.29 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.519 179.859 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 99.0 m -59.92 -42.25 93.53 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.912 179.703 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 51.1 mt-30 -58.23 -44.12 88.08 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.132 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.536 HD22 ' O ' ' A' ' 87' ' ' TYR . 19.4 mt -63.79 -42.92 97.65 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.897 178.919 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.518 HH12 ' C ' ' A' ' 98' ' ' LEU . 59.0 ttp180 -62.69 -35.88 81.12 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.323 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 14.3 t-20 -57.82 -41.42 82.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.607 -178.888 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 163.36 -175.96 39.58 Favored Glycine 0 CA--C 1.526 0.762 0 N-CA-C 110.972 -0.851 . . . . 0.0 110.972 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -74.58 135.03 19.35 Favored 'Trans proline' 0 N--CA 1.495 1.603 0 C-N-CA 122.812 2.341 . . . . 0.0 112.075 -179.533 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -157.02 98.82 2.01 Favored Pre-proline 0 CA--C 1.54 0.585 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.265 -178.833 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_exo -47.12 165.05 0.1 Allowed 'Trans proline' 0 C--N 1.301 -1.934 0 C-N-CA 122.321 2.014 . . . . 0.0 112.554 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 75.1 t -48.6 -43.48 13.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.693 -179.776 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 47.3 p -61.25 -39.86 91.91 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.504 179.569 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -64.71 -38.2 90.2 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.003 179.769 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.617 ' O ' HD13 ' A' ' 52' ' ' LEU . 0.2 OUTLIER -62.5 -46.84 86.62 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 120.42 -0.512 . . . . 0.0 110.223 179.811 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.525 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -55.18 -47.2 75.56 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.657 179.558 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 48.9 tp10 -55.38 -50.41 69.78 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.168 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.08 -58.22 7.21 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.767 -179.657 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 98.4 mt -85.7 -73.69 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.444 179.786 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLY . . . . . 0.525 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 131.62 94.51 0.63 Allowed Glycine 0 N--CA 1.461 0.358 0 N-CA-C 111.163 -0.775 . . . . 0.0 111.163 179.695 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 84.6 mmm 67.54 84.27 0.16 Allowed 'General case' 0 CA--C 1.521 -0.161 0 CA-C-O 120.829 0.347 . . . . 0.0 111.025 178.593 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 15.2 tt0 -169.32 28.15 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.275 179.588 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 22.0 mt-30 -66.45 -23.83 66.34 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.78 -179.335 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 15.5 t -66.06 -44.46 84.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.132 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.531 ' O ' ' NE2' ' A' ' 66' ' ' GLN . . . -63.4 -31.98 73.28 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.327 -179.695 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 60.2 t -72.6 -53.81 18.04 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.242 0 C-N-CA 120.746 -0.382 . . . . 0.0 110.647 -179.457 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 79.7 p -58.13 -40.3 80.94 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.909 -0.317 . . . . 0.0 110.165 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' HIS . . . . . 0.41 ' ND1' ' OE1' ' A' ' 66' ' ' GLN . 50.4 t-80 -65.86 -51.21 60.74 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.087 0.47 . . . . 0.0 110.845 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.531 ' NE2' ' O ' ' A' ' 62' ' ' ALA . 0.7 OUTLIER -61.9 -39.55 92.35 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.287 179.765 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.497 HD21 ' CE1' ' A' ' 87' ' ' TYR . 23.6 tp -61.8 -44.3 97.14 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.236 -179.49 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 21.0 mmt85 -61.67 -41.64 97.83 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 120.795 0.331 . . . . 0.0 110.516 -179.376 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.404 HG23 ' O ' ' A' ' 65' ' ' HIS . 94.0 t -61.2 -55.01 27.48 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.222 0 C-N-CA 120.224 -0.59 . . . . 0.0 110.262 -179.522 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 10.5 mp -62.0 -39.57 92.68 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 179.392 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 78.1 ttt-85 -51.96 -42.67 63.07 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.003 -179.552 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -60.63 -45.57 93.54 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.638 -0.425 . . . . 0.0 110.25 179.873 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.8 mt -65.84 -38.71 89.59 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.134 179.817 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 91.33 32.75 8.53 Favored Glycine 0 CA--C 1.522 0.522 0 N-CA-C 110.905 -0.878 . . . . 0.0 110.905 -179.534 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 91.2 mt -95.85 -1.33 49.71 Favored 'General case' 0 CA--C 1.519 -0.232 0 O-C-N 122.86 -0.2 . . . . 0.0 110.597 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.402 ' HA ' ' H ' ' A' ' 90' ' ' TYR . 26.8 m -134.28 155.97 39.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.191 -179.877 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 73.0 t -124.95 137.61 56.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.146 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -119.89 129.87 8.17 Favored Glycine 0 N--CA 1.465 0.589 0 N-CA-C 110.734 -0.946 . . . . 0.0 110.734 179.353 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -107.62 99.07 8.59 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 110.304 -0.258 . . . . 0.0 110.304 -179.8 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 73.0 ttt180 -85.29 125.96 33.33 Favored 'General case' 0 CA--C 1.519 -0.219 0 O-C-N 123.476 0.485 . . . . 0.0 110.413 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -173.15 144.13 1.19 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.712 179.775 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.496 ' O ' ' N ' ' A' ' 84' ' ' SER . . . 44.58 69.02 0.79 Allowed Glycine 0 C--N 1.329 0.19 0 N-CA-C 110.741 -0.944 . . . . 0.0 110.741 179.659 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.439 ' C ' ' O ' ' A' ' 82' ' ' GLY . 14.8 ptp180 32.76 34.09 0.01 OUTLIER 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.892 0.377 . . . . 0.0 110.857 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' SER . . . . . 0.496 ' N ' ' O ' ' A' ' 82' ' ' GLY . 54.7 p -144.02 122.69 12.56 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.18 -179.197 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 1.9 tp -114.87 124.88 71.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.11 179.746 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 99.5 t -101.14 121.36 51.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.577 178.506 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.536 ' O ' HD22 ' A' ' 42' ' ' LEU . 65.4 m-85 -98.62 125.2 43.81 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.133 179.768 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 86.7 p -142.24 160.62 39.89 Favored 'General case' 0 C--O 1.224 -0.271 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.438 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 7.3 mt -72.73 136.69 45.57 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.633 -179.849 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.468 ' CD1' ' C ' ' A' ' 90' ' ' TYR . 20.8 t80 -62.59 -51.52 67.0 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.743 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.5 m-20 -83.58 143.06 30.4 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.526 -179.409 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 98.9 m -94.21 -25.82 16.92 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.357 179.091 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' HIS . . . . . 0.62 ' CG ' ' ND1' ' B' ' 223' ' ' HIS . 71.1 m80 -58.23 -44.04 88.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.363 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.531 HG23 ' N ' ' A' ' 95' ' ' ALA . 20.0 m -56.04 -42.01 70.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.021 -179.862 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.531 ' N ' HG23 ' A' ' 94' ' ' VAL . . . -60.88 -45.97 92.46 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.997 0.427 . . . . 0.0 110.28 179.035 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 67.1 tp60 -62.04 -41.52 98.21 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.106 179.34 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.423 HD11 ' HG ' ' B' ' 216' ' ' LEU . 11.3 tp -58.56 -44.4 89.7 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.22 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.518 ' C ' HH12 ' A' ' 43' ' ' ARG . 87.1 mt -63.24 -39.54 94.91 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.227 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' ASP . . . . . 0.494 ' N ' ' NH1' ' A' ' 43' ' ' ARG . 52.1 m-20 -59.36 -41.24 88.82 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.747 0.308 . . . . 0.0 110.527 -179.481 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -69.53 -54.41 14.28 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.993 179.456 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.12 -43.23 91.94 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.443 -179.857 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.401 ' CG1' ' O ' ' A' ' 98' ' ' LEU . 4.1 mm -61.68 -45.54 98.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.328 -179.283 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 87.7 t80 -60.2 -39.7 87.47 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.865 0.365 . . . . 0.0 110.275 179.594 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' HIS . . . . . 0.574 ' ND1' ' CG ' ' B' ' 212' ' ' HIS . 57.6 t60 -63.76 -39.34 94.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.747 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.508 ' O ' HD13 ' A' ' 108' ' ' LEU . 29.8 t -75.7 -42.8 49.91 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.895 179.744 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 11.6 tm-20 -60.08 -37.86 81.17 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.495 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' HIS . . . . . 0.629 ' O ' ' N ' ' A' ' 109' ' ' HIS . 82.2 t60 -50.56 -70.13 0.09 Allowed 'General case' 0 CA--C 1.508 -0.647 0 CA-C-N 116.114 -0.493 . . . . 0.0 109.887 -179.048 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.527 ' O ' ' N ' ' A' ' 110' ' ' LEU . 1.0 OUTLIER 32.02 -83.82 0.0 OUTLIER 'General case' 0 CA--C 1.515 -0.4 0 O-C-N 123.32 0.388 . . . . 0.0 111.41 179.947 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 109' ' ' HIS . . . . . 0.629 ' N ' ' O ' ' A' ' 107' ' ' HIS . 37.4 m80 64.65 -45.2 0.32 Allowed 'General case' 0 C--N 1.332 -0.155 0 O-C-N 124.423 1.077 . . . . 0.0 110.188 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.527 ' N ' ' O ' ' A' ' 108' ' ' LEU . 82.6 mt -63.72 -42.15 97.96 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.766 179.709 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 75.95 77.7 0.72 Allowed Glycine 0 CA--C 1.525 0.669 0 N-CA-C 111.16 -0.776 . . . . 0.0 111.16 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.61 ' N ' HD22 ' A' ' 112' ' ' LEU . 3.5 mm? -76.51 142.39 40.91 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.828 0.347 . . . . 0.0 110.721 -179.738 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 4.0 m -50.82 87.7 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.42 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' ASP . . . . . 0.511 ' N ' ' O ' ' A' ' 112' ' ' LEU . 96.6 m-20 -88.3 151.42 22.64 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.492 179.835 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.406 ' H ' ' HG2' ' A' ' 115' ' ' ARG . 23.6 ptt180 -71.24 171.36 11.22 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.393 179.812 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 116' ' ' HIS . . . . . 0.404 ' O ' ' CG ' ' A' ' 116' ' ' HIS . 82.1 t60 -133.55 66.06 73.05 Favored Pre-proline 0 N--CA 1.465 0.279 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.476 -179.822 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -76.29 155.26 37.0 Favored 'Trans proline' 0 C--N 1.307 -1.644 0 C-N-CA 122.813 2.342 . . . . 0.0 112.028 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' SER . . . . . 0.429 ' O ' ' O ' ' A' ' 119' ' ' ALA . 35.5 t -151.59 88.04 1.4 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.512 179.468 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 119' ' ' ALA . . . . . 0.429 ' O ' ' O ' ' A' ' 118' ' ' SER . . . 40.61 -163.29 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.751 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.676 0 CA-C-O 117.931 -1.483 . . . . 0.0 110.872 179.862 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.305 0 N-CA-C 109.488 -1.445 . . . . 0.0 109.488 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 98.8 m-70 49.11 80.17 0.07 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.772 0.32 . . . . 0.0 110.551 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 123' ' ' GLY . . . . . . . . . . . . . . . -64.01 -40.64 98.39 Favored Glycine 0 CA--C 1.521 0.432 0 N-CA-C 111.01 -0.836 . . . . 0.0 111.01 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 31.2 m -137.68 159.66 34.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.811 0.339 . . . . 0.0 110.492 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 125' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -138.98 143.07 38.36 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.949 0.404 . . . . 0.0 110.555 179.77 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 79.51 0.89 85.43 Favored Glycine 0 CA--C 1.52 0.349 0 N-CA-C 110.971 -0.851 . . . . 0.0 110.971 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 127' ' ' ARG . . . . . . . . . . . . . 14.8 tpt180 -145.8 119.68 9.32 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.821 0.344 . . . . 0.0 110.618 179.765 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 128' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -155.29 125.45 6.69 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.639 179.814 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 129' ' ' ARG . . . . . . . . . . . . . 60.8 ttt180 53.96 62.39 9.0 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.526 179.765 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -67.98 146.88 72.76 Favored 'Trans proline' 0 C--N 1.308 -1.57 0 C-N-CA 122.717 2.278 . . . . 0.0 111.923 -179.815 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 27.0 m 55.08 86.76 0.05 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.601 179.497 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 132' ' ' ALA . . . . . 0.667 ' HB3' ' HD3' ' B' ' 133' ' ' PRO . . . -172.66 -62.0 0.0 OUTLIER Pre-proline 0 C--N 1.325 -0.487 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.312 -179.312 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 133' ' ' PRO . . . . . 0.667 ' HD3' ' HB3' ' B' ' 132' ' ' ALA . 19.8 Cg_endo -59.39 -31.65 95.23 Favored 'Trans proline' 0 C--N 1.31 -1.462 0 C-N-CA 122.615 2.21 . . . . 0.0 111.886 -179.395 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 134' ' ' LEU . . . . . 0.563 ' O ' ' N ' ' B' ' 136' ' ' SER . 57.5 mt -106.38 86.8 2.41 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.16 -179.531 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 94.3 m-20 -37.32 -24.68 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.172 0 O-C-N 123.44 0.462 . . . . 0.0 110.646 179.78 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 136' ' ' SER . . . . . 0.563 ' N ' ' O ' ' B' ' 134' ' ' LEU . 44.1 t -44.32 -49.31 9.53 Favored 'General case' 0 C--O 1.241 0.622 0 CA-C-O 121.088 0.47 . . . . 0.0 110.356 179.265 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 9.5 mp0 -64.19 -45.29 88.99 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.058 179.543 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 138' ' ' ALA . . . . . 0.631 ' O ' HG23 ' B' ' 142' ' ' VAL . . . -56.3 -28.65 59.49 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.189 -0.459 . . . . 0.0 109.872 179.849 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -71.66 -49.93 35.24 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 179.569 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -60.74 -45.48 94.12 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.338 -179.876 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -60.44 -51.56 68.94 Favored 'General case' 0 C--O 1.24 0.583 0 CA-C-O 121.134 0.492 . . . . 0.0 110.652 -179.361 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 142' ' ' VAL . . . . . 0.631 HG23 ' O ' ' B' ' 138' ' ' ALA . 95.1 t -60.42 -44.24 95.76 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.308 0 CA-C-N 115.888 -0.597 . . . . 0.0 109.993 179.786 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -56.86 -42.13 79.19 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.733 0.301 . . . . 0.0 110.274 179.69 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 70.4 m -59.08 -44.38 91.88 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.377 -179.838 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 145' ' ' THR . . . . . 0.48 ' OG1' ' O ' ' B' ' 142' ' ' VAL . 35.4 p -64.33 -51.37 63.73 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.702 179.753 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 146' ' ' LEU . . . . . 0.403 ' N ' ' CD1' ' B' ' 146' ' ' LEU . 7.6 mp -63.68 -21.51 66.42 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.805 179.502 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 147' ' ' GLN . . . . . 0.568 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 57.7 tt0 -74.68 -59.59 2.66 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.709 179.418 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -58.33 -54.77 43.2 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.685 -179.476 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.478 ' O ' ' O ' ' B' ' 150' ' ' ALA . 8.7 mp -48.42 -30.57 5.19 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.914 -0.314 . . . . 0.0 110.392 -179.891 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 150' ' ' ALA . . . . . 0.568 ' HB3' ' O ' ' B' ' 147' ' ' GLN . . . -58.08 -138.33 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.456 0 O-C-N 123.611 0.569 . . . . 0.0 110.144 179.702 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 151' ' ' THR . . . . . 0.482 ' O ' ' O ' ' B' ' 150' ' ' ALA . 27.2 m 56.1 117.37 0.01 OUTLIER Pre-proline 0 C--N 1.323 -0.557 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.438 179.636 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -48.25 -47.83 18.61 Favored 'Trans proline' 0 C--N 1.307 -1.624 0 C-N-CA 122.281 1.988 . . . . 0.0 112.901 -179.115 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 77.4 p -58.18 -48.92 78.81 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.933 -178.435 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 154' ' ' ARG . . . . . 0.412 HH21 HG21 ' B' ' 157' ' ' ILE . 1.1 mmp_? -67.39 -37.04 82.51 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.598 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 155' ' ' LEU . . . . . 0.515 ' O ' HD13 ' B' ' 155' ' ' LEU . 0.2 OUTLIER -60.24 -53.19 60.63 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.399 -0.52 . . . . 0.0 110.714 -178.347 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 156' ' ' MET . . . . . 0.457 ' C ' ' SD ' ' B' ' 156' ' ' MET . 1.0 OUTLIER -61.15 -45.65 93.77 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.452 179.981 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 157' ' ' ILE . . . . . 0.412 HG21 HH21 ' B' ' 154' ' ' ARG . 92.6 mt -60.93 -43.75 96.51 Favored 'Isoleucine or valine' 0 C--O 1.242 0.667 0 CA-C-O 121.227 0.537 . . . . 0.0 110.434 -179.616 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 17.0 mt -62.29 -40.13 95.27 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.395 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 19.7 m -59.87 -43.2 94.84 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.158 179.551 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 56.8 mt-30 -57.9 -44.25 86.64 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.077 179.72 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 161' ' ' LEU . . . . . 0.53 HD22 ' O ' ' B' ' 206' ' ' TYR . 20.0 mt -63.95 -42.89 97.17 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.915 179.02 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 162' ' ' ARG . . . . . 0.53 HH12 ' C ' ' B' ' 217' ' ' LEU . 58.7 ttp180 -62.9 -35.45 80.09 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.253 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 17.1 t-20 -58.19 -44.61 88.16 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.747 -178.649 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . 167.46 -174.86 42.6 Favored Glycine 0 CA--C 1.526 0.777 0 N-CA-C 110.989 -0.844 . . . . 0.0 110.989 179.788 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -75.51 133.23 15.61 Favored 'Trans proline' 0 N--CA 1.494 1.543 0 C-N-CA 122.839 2.359 . . . . 0.0 111.997 -179.728 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -155.41 99.08 2.3 Favored Pre-proline 0 CA--C 1.539 0.555 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.275 -178.882 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_exo -47.56 165.28 0.12 Allowed 'Trans proline' 0 C--N 1.3 -2.015 0 C-N-CA 122.45 2.1 . . . . 0.0 112.411 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . 87.5 t -48.75 -43.4 14.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.68 -179.683 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 169' ' ' THR . . . . . . . . . . . . . 63.4 p -61.45 -39.52 91.14 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.446 179.613 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.83 -38.63 91.64 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.151 179.516 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 171' ' ' LEU . . . . . 0.607 ' O ' HD13 ' B' ' 171' ' ' LEU . 0.2 OUTLIER -62.29 -46.56 88.21 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 120.309 -0.556 . . . . 0.0 110.149 179.771 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 172' ' ' ALA . . . . . 0.55 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -55.45 -47.18 76.46 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 179.435 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 43.8 tp10 -55.43 -50.56 69.48 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.424 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -52.0 -57.22 10.12 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 120.81 -0.356 . . . . 0.0 110.774 -179.592 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 175' ' ' ILE . . . . . 0.452 HD13 ' OE1' ' B' ' 178' ' ' GLU . 99.1 mt -87.1 -70.99 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.522 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 176' ' ' GLY . . . . . 0.55 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 128.14 94.36 0.81 Allowed Glycine 0 N--CA 1.461 0.357 0 N-CA-C 111.136 -0.786 . . . . 0.0 111.136 179.696 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 83.8 mmm 68.96 86.46 0.13 Allowed 'General case' 0 C--N 1.34 0.189 0 C-N-CA 120.899 -0.32 . . . . 0.0 110.981 178.388 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 178' ' ' GLU . . . . . 0.46 ' HG2' ' HB3' ' B' ' 181' ' ' ALA . 47.3 tt0 -172.53 28.01 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.193 179.306 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 22.4 mt-30 -66.75 -23.8 66.13 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.762 -179.531 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 11.9 t -66.53 -44.12 83.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.028 -179.721 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 181' ' ' ALA . . . . . 0.522 ' O ' ' NE2' ' B' ' 185' ' ' GLN . . . -63.7 -32.39 73.86 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.482 -179.765 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 65.0 t -71.94 -53.56 19.73 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 C-N-CA 120.664 -0.414 . . . . 0.0 110.655 -179.314 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 77.5 p -58.36 -39.92 80.85 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.91 -0.316 . . . . 0.0 110.247 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 184' ' ' HIS . . . . . 0.4 ' ND1' ' OE1' ' B' ' 185' ' ' GLN . 49.6 t-80 -65.68 -51.11 62.0 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.714 179.897 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 185' ' ' GLN . . . . . 0.522 ' NE2' ' O ' ' B' ' 181' ' ' ALA . 0.8 OUTLIER -62.23 -40.62 96.73 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.36 179.835 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 186' ' ' LEU . . . . . 0.434 HD21 ' CE1' ' B' ' 206' ' ' TYR . 17.5 tp -60.67 -44.61 96.28 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.105 -179.651 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 21.5 mmt85 -60.99 -41.84 97.26 Favored 'General case' 0 C--O 1.24 0.563 0 CA-C-O 120.81 0.338 . . . . 0.0 110.546 -179.513 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 87.9 t -61.14 -54.93 28.51 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.177 0 C-N-CA 120.25 -0.58 . . . . 0.0 110.19 -179.517 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 10.5 mp -62.0 -39.68 93.08 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 110.152 -0.314 . . . . 0.0 110.152 179.399 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 77.1 ttt-85 -51.48 -42.9 61.96 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.03 -179.488 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 55.4 t30 -60.57 -45.57 93.43 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.461 179.725 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 192' ' ' LEU . . . . . . . . . . . . . 10.1 mt -65.26 -39.36 92.53 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.196 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 91.6 33.2 8.09 Favored Glycine 0 CA--C 1.524 0.61 0 N-CA-C 110.821 -0.912 . . . . 0.0 110.821 -179.62 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 77.8 mt -97.33 -0.74 45.94 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.513 0.197 . . . . 0.0 110.632 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 24.9 m -134.26 155.58 39.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.263 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 196' ' ' VAL . . . . . . . . . . . . . 76.1 t -125.57 138.98 52.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.128 -179.876 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 197' ' ' GLY . . . . . . . . . . . . . . . -121.65 130.66 8.19 Favored Glycine 0 N--CA 1.464 0.548 0 N-CA-C 110.823 -0.911 . . . . 0.0 110.823 179.697 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -107.8 99.64 9.09 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 110.305 -0.257 . . . . 0.0 110.305 -179.813 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 72.7 ttt180 -85.23 126.46 33.69 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.399 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 200' ' ' ALA . . . . . . . . . . . . . . . -173.32 144.5 1.19 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.687 179.614 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 201' ' ' GLY . . . . . 0.518 ' O ' ' N ' ' B' ' 203' ' ' SER . . . 43.63 69.2 0.7 Allowed Glycine 0 C--N 1.329 0.191 0 N-CA-C 110.779 -0.929 . . . . 0.0 110.779 179.771 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 202' ' ' ARG . . . . . 0.432 ' C ' ' O ' ' B' ' 201' ' ' GLY . 15.3 ptp180 33.46 32.6 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.915 0.388 . . . . 0.0 110.869 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 203' ' ' SER . . . . . 0.518 ' N ' ' O ' ' B' ' 201' ' ' GLY . 54.6 p -142.64 123.07 13.97 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.163 -179.163 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 1.8 tp -115.64 123.86 71.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.061 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 89.5 t -99.83 120.96 49.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.609 178.496 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 206' ' ' TYR . . . . . 0.53 ' O ' HD22 ' B' ' 161' ' ' LEU . 68.6 m-85 -98.18 125.36 43.19 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.309 179.819 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 34.2 p -142.68 160.69 39.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.335 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . 6.0 mt -73.17 138.07 45.47 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.751 -179.82 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 209' ' ' TYR . . . . . 0.461 ' C ' ' CD1' ' B' ' 209' ' ' TYR . 22.3 t80 -63.46 -52.39 61.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.801 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 43.1 m-20 -82.7 142.5 31.61 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.474 -179.339 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 99.3 m -94.6 -24.06 17.37 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-O 121.068 0.461 . . . . 0.0 110.33 179.223 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 212' ' ' HIS . . . . . 0.574 ' CG ' ' ND1' ' A' ' 104' ' ' HIS . 72.2 m80 -59.5 -43.79 93.27 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.211 179.755 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 213' ' ' VAL . . . . . 0.554 HG23 ' N ' ' B' ' 214' ' ' ALA . 15.5 m -56.1 -42.77 73.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.021 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 214' ' ' ALA . . . . . 0.554 ' N ' HG23 ' B' ' 213' ' ' VAL . . . -59.9 -46.41 89.44 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.188 179.013 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 68.4 tp60 -61.36 -41.15 96.6 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.019 179.497 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 216' ' ' LEU . . . . . 0.423 ' HG ' HD11 ' A' ' 97' ' ' LEU . 10.0 tp -59.04 -43.99 91.71 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.268 -179.867 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 217' ' ' LEU . . . . . 0.53 ' C ' HH12 ' B' ' 162' ' ' ARG . 91.3 mt -63.51 -38.96 93.14 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.229 179.709 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 218' ' ' ASP . . . . . 0.478 ' N ' ' NH1' ' B' ' 162' ' ' ARG . 69.3 m-20 -59.66 -41.55 90.84 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.889 0.376 . . . . 0.0 110.603 -179.52 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 219' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -69.52 -54.92 11.81 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.984 179.581 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -58.15 -43.76 87.55 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.4 -179.686 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 221' ' ' ILE . . . . . 0.414 ' CG1' ' O ' ' B' ' 217' ' ' LEU . 4.1 mm -61.47 -45.91 97.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.388 -178.987 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 86.5 t80 -60.94 -40.14 92.13 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.244 179.757 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 223' ' ' HIS . . . . . 0.62 ' ND1' ' CG ' ' A' ' 93' ' ' HIS . 41.4 t60 -61.5 -41.92 98.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.032 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 224' ' ' SER . . . . . 0.573 ' O ' HD13 ' B' ' 227' ' ' LEU . 35.6 t -73.63 -40.79 63.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.013 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 225' ' ' GLU . . . . . 0.404 ' C ' ' H ' ' B' ' 227' ' ' LEU . 11.4 tm-20 -65.29 -31.38 72.49 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.708 -179.746 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 226' ' ' HIS . . . . . 0.51 ' CG ' ' O ' ' B' ' 226' ' ' HIS . 52.1 t-80 -68.94 3.84 1.81 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.689 -179.52 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 227' ' ' LEU . . . . . 0.573 HD13 ' O ' ' B' ' 224' ' ' SER . 0.6 OUTLIER -40.01 -72.39 0.06 Allowed 'General case' 0 CA--C 1.513 -0.471 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.716 -179.818 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 228' ' ' HIS . . . . . . . . . . . . . 36.6 m80 62.73 -56.31 0.15 Allowed 'General case' 0 C--N 1.334 -0.095 0 O-C-N 124.23 0.956 . . . . 0.0 110.997 179.666 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 229' ' ' LEU . . . . . 0.506 ' N ' ' O ' ' B' ' 227' ' ' LEU . 73.6 mt -58.57 -42.2 87.4 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.598 -179.299 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . 72.83 79.34 0.48 Allowed Glycine 0 CA--C 1.522 0.504 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 179.515 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 231' ' ' LEU . . . . . 0.594 HD22 ' N ' ' B' ' 231' ' ' LEU . 3.7 mm? -76.0 143.94 41.2 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.658 0.266 . . . . 0.0 110.737 -179.842 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 232' ' ' SER . . . . . . . . . . . . . 4.7 m -50.23 87.8 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.405 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 233' ' ' ASP . . . . . 0.512 ' N ' ' O ' ' B' ' 231' ' ' LEU . 97.1 m-20 -88.46 156.09 19.31 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.455 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 234' ' ' ARG . . . . . . . . . . . . . 23.6 ptt180 -75.84 171.18 14.84 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.451 179.712 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 235' ' ' HIS . . . . . . . . . . . . . 83.7 t60 -132.85 66.42 76.32 Favored Pre-proline 0 N--CA 1.465 0.293 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.533 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 236' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -75.76 156.67 39.68 Favored 'Trans proline' 0 C--N 1.308 -1.592 0 C-N-CA 122.908 2.406 . . . . 0.0 112.026 179.65 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 237' ' ' SER . . . . . 0.429 ' O ' ' O ' ' B' ' 238' ' ' ALA . 23.2 t -153.68 86.67 1.2 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.525 179.443 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 238' ' ' ALA . . . . . 0.429 ' O ' ' O ' ' B' ' 237' ' ' SER . . . 41.91 -165.5 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.654 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.219 -0.796 0 CA-C-O 117.984 -1.453 . . . . 0.0 110.843 179.938 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLY . . . . . 0.404 ' O ' HG13 ' A' ' 5' ' ' VAL . . . . . . . . 0 N--CA 1.491 2.303 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 71.4 t60 -83.94 -5.96 59.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.806 0.336 . . . . 0.0 110.562 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -76.51 2.49 57.99 Favored Glycine 0 CA--C 1.524 0.601 0 N-CA-C 110.968 -0.853 . . . . 0.0 110.968 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.404 HG13 ' O ' ' A' ' 2' ' ' GLY . 27.7 m -64.92 -33.93 66.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 120.948 0.404 . . . . 0.0 110.774 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -62.89 140.49 58.82 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.654 -179.865 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -177.57 -115.47 0.44 Allowed Glycine 0 CA--C 1.524 0.615 0 N-CA-C 110.945 -0.862 . . . . 0.0 110.945 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.517 ' NH2' ' NH1' ' A' ' 10' ' ' ARG . 84.8 mtp180 -79.46 -9.29 59.58 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.781 0.324 . . . . 0.0 110.521 -179.845 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 65.6 t30 59.59 40.32 20.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.372 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.517 ' NH1' ' NH2' ' A' ' 8' ' ' ARG . 72.3 mtt180 -110.62 150.24 41.44 Favored Pre-proline 0 C--O 1.233 0.193 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.53 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -68.06 153.38 75.15 Favored 'Trans proline' 0 C--N 1.31 -1.447 0 C-N-CA 122.684 2.256 . . . . 0.0 112.057 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 86.4 p -142.34 87.06 1.99 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.317 179.795 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -169.42 61.73 0.44 Allowed Pre-proline 0 C--N 1.331 -0.213 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.362 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -72.4 113.99 3.87 Favored 'Trans proline' 0 N--CA 1.494 1.552 0 C-N-CA 122.667 2.245 . . . . 0.0 111.85 -179.764 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.545 ' O ' ' N ' ' A' ' 17' ' ' SER . 38.7 mt -77.6 -143.99 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.277 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 93.7 m-20 -42.43 -17.7 0.01 OUTLIER 'General case' 0 C--O 1.224 -0.267 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.7 179.808 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.545 ' N ' ' O ' ' A' ' 15' ' ' LEU . 47.6 t -38.74 -49.91 1.62 Allowed 'General case' 0 C--O 1.239 0.518 0 CA-C-O 121.383 0.611 . . . . 0.0 110.606 -179.661 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.408 ' HG2' ' H ' ' A' ' 18' ' ' GLN . 3.0 pt20 -64.64 -46.43 82.57 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.003 179.319 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.632 ' O ' HG23 ' A' ' 23' ' ' VAL . . . -58.43 -28.65 65.46 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.221 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.464 ' HB1' ' HB3' ' B' ' 155' ' ' LEU . . . -70.97 -51.0 28.23 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 120.888 0.375 . . . . 0.0 110.128 179.834 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.49 -40.53 96.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.557 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -62.31 -50.43 71.67 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-O 121.417 0.627 . . . . 0.0 110.444 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.632 HG23 ' O ' ' A' ' 19' ' ' ALA . 93.9 t -61.74 -43.36 97.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.98 179.712 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.71 -41.4 81.67 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 58.9 m -59.47 -45.25 92.16 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.154 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.438 ' OG1' ' O ' ' A' ' 23' ' ' VAL . 22.6 p -63.99 -44.58 92.26 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-O 120.937 0.398 . . . . 0.0 110.442 179.551 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 95.9 mt -67.13 -21.73 65.83 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.332 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.49 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 60.1 tt0 -74.49 -58.18 3.45 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.274 179.71 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.98 -55.19 31.9 Favored 'General case' 0 CA--C 1.52 -0.205 0 C-N-CA 120.511 -0.476 . . . . 0.0 110.276 -179.724 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.487 ' O ' ' O ' ' A' ' 31' ' ' ALA . 50.3 tp -43.94 -32.34 1.1 Allowed 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 110.12 -0.326 . . . . 0.0 110.12 -178.524 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.49 ' HB3' ' O ' ' A' ' 28' ' ' GLN . . . -58.24 -136.2 0.0 OUTLIER 'General case' 0 C--O 1.218 -0.6 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.84 178.99 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.453 ' O ' ' O ' ' A' ' 31' ' ' ALA . 9.4 m 55.12 113.15 0.02 OUTLIER Pre-proline 0 CA--C 1.538 0.488 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.836 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_exo -47.84 -45.77 23.45 Favored 'Trans proline' 0 C--N 1.309 -1.505 0 C-N-CA 122.395 2.064 . . . . 0.0 113.247 -179.211 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 51.7 m -54.14 -42.89 70.04 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.132 0.492 . . . . 0.0 111.188 -179.338 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.5 mmp_? -68.39 -34.42 76.01 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.066 179.832 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.49 ' O ' HG23 ' A' ' 40' ' ' THR . 3.6 mm? -64.55 -56.23 15.39 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.431 -0.508 . . . . 0.0 111.84 -179.025 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.493 ' O ' ' OG1' ' A' ' 40' ' ' THR . 3.3 ptm -58.26 -44.06 88.19 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.092 0.473 . . . . 0.0 110.037 179.752 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 92.4 mt -64.02 -43.9 97.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 121.492 0.663 . . . . 0.0 110.144 179.11 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.483 HD11 HD21 ' A' ' 89' ' ' LEU . 64.0 tp -59.51 -41.17 89.31 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.927 -179.575 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.493 ' OG1' ' O ' ' A' ' 37' ' ' MET . 41.4 p -63.93 -35.78 81.78 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.309 -179.754 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 89.8 mm-40 -63.61 -50.81 67.93 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 120.501 -0.48 . . . . 0.0 110.245 179.585 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 78.9 mt -63.44 -32.86 74.42 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.666 179.721 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 61.5 ttp180 -53.16 -39.49 63.61 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.197 -179.44 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 43.0 t-20 -61.92 -41.1 97.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.815 0.34 . . . . 0.0 110.593 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 168.5 177.62 39.64 Favored Glycine 0 CA--C 1.527 0.785 0 N-CA-C 111.016 -0.833 . . . . 0.0 111.016 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_endo -69.43 152.38 71.03 Favored 'Trans proline' 0 C--N 1.309 -1.503 0 C-N-CA 122.893 2.395 . . . . 0.0 111.897 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 1.3 pp 178.59 148.28 0.39 Allowed Pre-proline 0 N--CA 1.451 -0.418 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.789 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -72.63 -175.66 1.94 Allowed 'Trans proline' 0 N--CA 1.494 1.547 0 C-N-CA 122.756 2.304 . . . . 0.0 112.208 178.904 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.765 HG23 ' H ' ' A' ' 50' ' ' THR . 33.1 m -75.79 -61.42 1.7 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.582 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.912 179.471 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.765 ' H ' HG23 ' A' ' 49' ' ' VAL . 71.8 p -29.32 -46.1 0.05 Allowed 'General case' 0 N--CA 1.475 0.801 0 CA-C-O 121.464 0.649 . . . . 0.0 110.362 -179.449 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -62.33 -43.55 98.55 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.099 178.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.695 ' N ' ' O ' ' A' ' 49' ' ' VAL . 0.2 OUTLIER -61.33 -38.62 87.57 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.846 -179.754 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.533 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -61.53 -43.85 98.12 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.635 -0.505 . . . . 0.0 109.635 179.712 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -57.0 -46.48 82.24 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 179.628 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.28 -49.46 77.74 Favored 'General case' 0 C--O 1.231 0.094 0 C-N-CA 120.73 -0.388 . . . . 0.0 110.248 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 96.3 mt -92.7 -79.22 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.346 179.502 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLY . . . . . 0.533 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 141.76 89.73 0.14 Allowed Glycine 0 CA--C 1.519 0.331 0 N-CA-C 111.171 -0.772 . . . . 0.0 111.171 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 32.0 ttp 69.23 105.94 0.06 Allowed 'General case' 0 CA--C 1.52 -0.21 0 CA-C-O 120.53 0.205 . . . . 0.0 110.682 179.261 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 176.05 10.98 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.528 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -53.8 -37.56 63.64 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.705 -179.293 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 4.8 t -61.45 -48.94 78.83 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.951 -179.548 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.4 -35.68 68.05 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.224 -179.748 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 90.2 t -69.42 -52.96 27.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 C-N-CA 120.524 -0.47 . . . . 0.0 110.778 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 78.3 p -56.32 -43.32 78.88 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.876 0.369 . . . . 0.0 110.53 -179.79 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 55.9 t-80 -63.76 -51.07 66.51 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.019 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -61.04 -38.4 86.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.417 179.708 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.409 HD21 ' CD1' ' A' ' 87' ' ' TYR . 54.4 tp -60.84 -45.35 94.83 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.428 -179.81 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 74.1 ttt180 -60.77 -45.37 94.62 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-O 121.091 0.472 . . . . 0.0 110.509 -179.521 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 91.4 t -65.54 -54.5 27.53 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.386 0 C-N-CA 120.203 -0.599 . . . . 0.0 110.583 -179.759 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 97.7 mt -56.37 -40.73 75.04 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 -179.435 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 59.1 ttt85 -57.83 -39.64 78.15 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.26 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 97.6 m-20 -62.24 -43.54 98.59 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 120.548 -0.461 . . . . 0.0 110.594 -179.464 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.474 HD23 ' N ' ' A' ' 73' ' ' LEU . 7.0 mt -65.9 -44.72 84.4 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-O 120.953 0.406 . . . . 0.0 110.587 -179.29 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 104.15 96.56 2.41 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 111.612 -0.595 . . . . 0.0 111.612 179.606 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -171.92 -6.11 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.898 0.38 . . . . 0.0 110.654 179.205 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 30.8 m -138.83 157.62 29.52 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.19 179.656 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.423 HG12 ' N ' ' A' ' 78' ' ' GLY . 61.2 t -143.82 155.59 15.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.432 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.423 ' N ' HG12 ' A' ' 77' ' ' VAL . . . -126.41 144.89 15.4 Favored Glycine 0 N--CA 1.462 0.429 0 N-CA-C 110.446 -1.062 . . . . 0.0 110.446 179.378 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 -103.56 117.48 34.51 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 110.349 -0.241 . . . . 0.0 110.349 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 61.7 ttp180 -96.82 136.6 37.14 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.541 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -145.5 95.66 2.7 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.628 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 60.61 -85.83 0.02 OUTLIER Glycine 0 CA--C 1.523 0.563 0 N-CA-C 110.71 -0.956 . . . . 0.0 110.71 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 85.0 mtp180 -129.45 12.29 5.92 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.615 0.245 . . . . 0.0 110.648 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 50.6 m -117.47 108.84 16.01 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-O 120.914 0.387 . . . . 0.0 110.485 179.861 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 2.7 tp -117.34 130.46 72.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.832 179.57 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 20.1 m -123.05 159.39 27.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.355 179.146 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.409 ' CD1' HD21 ' A' ' 67' ' ' LEU . 27.7 m-85 -115.75 136.58 52.91 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.463 -179.66 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 20.1 m -151.07 171.95 16.51 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.193 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.614 ' N ' HD12 ' A' ' 89' ' ' LEU . 8.3 mp -74.8 146.64 41.89 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.494 -179.91 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 58.6 t80 -52.18 -47.52 65.5 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.493 179.8 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.552 ' CG ' ' H ' ' A' ' 92' ' ' THR . 43.4 t0 -155.4 -177.42 6.54 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.387 -179.799 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' THR . . . . . 0.552 ' H ' ' CG ' ' A' ' 91' ' ' ASP . 5.5 t -77.48 6.84 6.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.451 -179.808 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' HIS . . . . . 0.417 ' CE1' ' OD2' ' A' ' 91' ' ' ASP . 34.9 m80 -62.27 -73.39 0.11 Allowed 'General case' 0 C--O 1.236 0.345 0 CA-C-O 120.976 0.417 . . . . 0.0 110.308 179.889 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 82.4 t -45.22 -40.19 2.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.29 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.46 -39.61 93.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.524 179.762 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 8.8 tp-100 -60.54 -47.43 86.2 Favored 'General case' 0 C--O 1.241 0.632 0 CA-C-O 121.095 0.474 . . . . 0.0 110.176 -179.412 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.649 HD21 ' HA ' ' B' ' 220' ' ' ALA . 7.2 mp -62.86 -43.28 99.22 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.263 -179.626 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 7.0 tp -63.58 -39.7 95.07 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.029 179.828 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 47.4 t0 -56.48 -47.63 78.82 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.169 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.531 ' N ' ' OE1' ' A' ' 100' ' ' GLU . 0.3 OUTLIER -63.33 -51.56 65.45 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 120.639 -0.425 . . . . 0.0 110.279 179.678 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.665 ' HA ' HD21 ' B' ' 216' ' ' LEU . . . -56.48 -43.01 79.23 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.575 179.893 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 4.1 mm -61.45 -45.6 98.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 C-N-CA 120.512 -0.475 . . . . 0.0 110.502 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 85.1 t80 -61.85 -45.02 95.62 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.981 0.42 . . . . 0.0 110.449 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 11.6 t-160 -55.43 -45.24 76.78 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.601 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 35.3 t -76.07 -33.64 59.56 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.859 179.697 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 78.7 tt0 -58.88 -38.93 79.94 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.378 -179.471 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' HIS . . . . . 0.427 ' O ' ' O ' ' A' ' 108' ' ' LEU . 7.6 t60 -55.03 -71.62 0.08 Allowed 'General case' 0 CA--C 1.521 -0.168 0 C-N-CA 120.503 -0.479 . . . . 0.0 110.159 -179.289 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.518 ' N ' HD22 ' A' ' 108' ' ' LEU . 4.0 mm? -56.8 -110.21 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.062 -179.656 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' HIS . . . . . 0.453 ' O ' ' CG ' ' A' ' 109' ' ' HIS . 83.8 t60 37.44 41.11 0.24 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.841 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 1.8 pp -67.81 -36.46 80.44 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.259 -179.778 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 147.08 42.66 0.04 OUTLIER Glycine 0 CA--C 1.523 0.548 0 N-CA-C 110.985 -0.846 . . . . 0.0 110.985 -179.772 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.474 ' O ' HD12 ' A' ' 112' ' ' LEU . 0.3 OUTLIER -101.38 175.95 5.4 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 121.028 0.442 . . . . 0.0 110.242 -179.994 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 23.1 m -102.53 114.22 28.24 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.415 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -64.78 -37.46 87.68 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.551 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 7.6 ptm180 -149.86 135.05 18.06 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.159 0.504 . . . . 0.0 110.715 -179.855 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' HIS . . . . . 0.576 ' N ' ' CD ' ' A' ' 117' ' ' PRO . 0.0 OUTLIER 169.37 -46.16 0.0 OUTLIER Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.809 -179.806 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 117' ' ' PRO . . . . . 0.576 ' CD ' ' N ' ' A' ' 116' ' ' HIS . 31.9 Cg_exo -56.81 -47.47 23.23 Favored 'Trans proline' 0 C--N 1.311 -1.436 0 C-N-CA 122.522 2.148 . . . . 0.0 111.903 -178.456 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 43.3 t -63.07 -43.99 97.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.674 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -66.82 142.3 57.4 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.542 -179.845 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.708 0 CA-C-O 117.991 -1.45 . . . . 0.0 110.917 179.963 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.332 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 70.1 t60 -85.07 -4.87 59.31 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.779 0.323 . . . . 0.0 110.623 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 123' ' ' GLY . . . . . . . . . . . . . . . -77.26 1.95 63.22 Favored Glycine 0 CA--C 1.525 0.71 0 N-CA-C 110.945 -0.862 . . . . 0.0 110.945 -179.823 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 124' ' ' VAL . . . . . 0.415 HG23 ' N ' ' B' ' 125' ' ' GLU . 27.3 m -64.53 -38.41 82.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 120.906 0.384 . . . . 0.0 110.773 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 125' ' ' GLU . . . . . 0.415 ' N ' HG23 ' B' ' 124' ' ' VAL . 97.5 mt-10 -58.59 141.1 53.2 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.582 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -178.86 -115.37 0.46 Allowed Glycine 0 CA--C 1.525 0.699 0 N-CA-C 110.913 -0.875 . . . . 0.0 110.913 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 127' ' ' ARG . . . . . 0.557 ' NH2' ' NH1' ' B' ' 129' ' ' ARG . 85.3 mtp180 -79.19 -8.08 58.73 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.86 0.362 . . . . 0.0 110.573 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 128' ' ' ASN . . . . . . . . . . . . . 66.4 t30 57.92 41.45 24.53 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.494 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 129' ' ' ARG . . . . . 0.557 ' NH1' ' NH2' ' B' ' 127' ' ' ARG . 81.0 mtt180 -112.01 150.29 42.17 Favored Pre-proline 0 CA--C 1.531 0.223 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.538 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -67.91 154.73 72.15 Favored 'Trans proline' 0 N--CA 1.492 1.401 0 C-N-CA 122.646 2.23 . . . . 0.0 111.903 179.622 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 63.8 p -143.93 86.21 1.85 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.501 179.876 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 132' ' ' ALA . . . . . . . . . . . . . . . -169.04 65.11 0.58 Allowed Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.41 179.82 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 133' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -74.9 113.75 3.87 Favored 'Trans proline' 0 N--CA 1.493 1.469 0 C-N-CA 122.606 2.204 . . . . 0.0 112.042 -179.688 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 134' ' ' LEU . . . . . 0.546 ' O ' ' N ' ' B' ' 136' ' ' SER . 38.9 mt -77.03 -144.67 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.311 -179.859 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 97.0 m-20 -42.58 -17.51 0.01 OUTLIER 'General case' 0 C--O 1.224 -0.28 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.746 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 136' ' ' SER . . . . . 0.546 ' N ' ' O ' ' B' ' 134' ' ' LEU . 27.3 t -39.32 -49.89 1.99 Allowed 'General case' 0 C--O 1.238 0.49 0 CA-C-O 121.439 0.637 . . . . 0.0 110.479 -179.655 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -64.23 -45.99 85.8 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.902 179.352 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 138' ' ' ALA . . . . . 0.608 ' O ' HG23 ' B' ' 142' ' ' VAL . . . -58.74 -28.27 65.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.419 -179.878 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 139' ' ' ALA . . . . . 0.461 ' HB1' ' HB3' ' A' ' 36' ' ' LEU . . . -71.39 -50.74 29.02 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-O 120.85 0.357 . . . . 0.0 110.168 179.865 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -62.78 -40.95 98.91 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.522 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -61.68 -51.19 69.46 Favored 'General case' 0 C--O 1.24 0.586 0 CA-C-O 121.395 0.617 . . . . 0.0 110.457 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 142' ' ' VAL . . . . . 0.608 HG23 ' O ' ' B' ' 138' ' ' ALA . 85.8 t -61.32 -44.33 98.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.013 179.844 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -56.38 -41.34 76.07 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 62.1 m -59.32 -45.36 91.53 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.178 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 46.9 p -64.0 -44.87 91.34 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.311 179.434 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 96.0 mt -66.4 -22.41 66.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.425 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 147' ' ' GLN . . . . . 0.525 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 59.5 tt0 -74.12 -59.08 2.89 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.29 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -60.78 -55.01 38.18 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 120.571 -0.452 . . . . 0.0 110.308 -179.632 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.475 ' O ' ' O ' ' B' ' 150' ' ' ALA . 47.8 tp -44.31 -31.3 0.99 Allowed 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 120.914 -0.314 . . . . 0.0 110.212 -178.684 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 150' ' ' ALA . . . . . 0.525 ' HB3' ' O ' ' B' ' 147' ' ' GLN . . . -59.16 -135.93 0.0 OUTLIER 'General case' 0 C--O 1.219 -0.524 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.614 179.07 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 151' ' ' THR . . . . . 0.454 ' O ' ' O ' ' B' ' 150' ' ' ALA . 10.1 m 53.97 113.31 0.01 OUTLIER Pre-proline 0 CA--C 1.538 0.505 0 CA-C-N 116.574 -0.284 . . . . 0.0 110.67 179.915 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -48.68 -46.89 22.63 Favored 'Trans proline' 0 C--N 1.309 -1.503 0 C-N-CA 122.169 1.913 . . . . 0.0 113.209 -178.865 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 66.8 m -52.91 -38.77 62.18 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.541 0.686 . . . . 0.0 111.052 -179.359 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 154' ' ' ARG . . . . . 0.4 HH11 ' HD3' ' B' ' 154' ' ' ARG . 3.5 mmp_? -71.75 -35.15 70.02 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.993 179.581 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 155' ' ' LEU . . . . . 0.464 ' HB3' ' HB1' ' A' ' 20' ' ' ALA . 3.8 mm? -64.16 -55.77 19.46 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.43 -0.508 . . . . 0.0 111.603 -179.046 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 156' ' ' MET . . . . . 0.432 ' O ' ' OG1' ' B' ' 159' ' ' THR . 0.1 OUTLIER -56.73 -46.26 81.42 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 179.677 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 97.4 mt -62.82 -43.04 98.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 C-N-CA 120.199 -0.6 . . . . 0.0 110.209 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 158' ' ' LEU . . . . . 0.477 HD11 HD21 ' B' ' 208' ' ' LEU . 58.4 tp -60.8 -42.59 97.93 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.287 -179.509 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 159' ' ' THR . . . . . 0.432 ' OG1' ' O ' ' B' ' 156' ' ' MET . 37.1 p -62.37 -35.37 78.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.112 -179.884 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 91.6 mm-40 -65.01 -50.75 65.04 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.965 0.412 . . . . 0.0 110.405 179.434 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 161' ' ' LEU . . . . . . . . . . . . . 82.2 mt -62.61 -32.64 73.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.72 179.766 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 162' ' ' ARG . . . . . . . . . . . . . 61.8 ttp180 -53.59 -39.04 64.52 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.33 -179.755 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 54.9 t-20 -61.19 -41.11 96.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.945 0.402 . . . . 0.0 110.405 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . 164.55 -176.7 40.38 Favored Glycine 0 CA--C 1.525 0.692 0 N-CA-C 111.12 -0.792 . . . . 0.0 111.12 179.433 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_exo -66.7 150.4 83.6 Favored 'Trans proline' 0 C--N 1.308 -1.6 0 C-N-CA 122.964 2.443 . . . . 0.0 111.937 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 1.7 pp -177.39 146.3 0.63 Allowed Pre-proline 0 N--CA 1.449 -0.509 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.573 178.924 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -74.53 174.99 11.66 Favored 'Trans proline' 0 N--CA 1.493 1.495 0 C-N-CA 122.873 2.382 . . . . 0.0 112.167 179.546 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . 3.6 m -71.42 -32.77 47.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 121.945 0.879 . . . . 0.0 110.808 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 169' ' ' THR . . . . . . . . . . . . . 50.4 p -58.16 -39.97 80.2 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-N 114.563 -1.199 . . . . 0.0 110.465 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 68.1 m-20 -68.53 -37.97 80.44 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.588 179.625 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 171' ' ' LEU . . . . . 0.627 ' O ' HD13 ' B' ' 171' ' ' LEU . 0.2 OUTLIER -63.76 -38.59 91.66 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.096 -179.365 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 172' ' ' ALA . . . . . 0.517 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -62.81 -46.64 87.01 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.661 179.85 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -56.12 -44.66 79.35 Favored 'General case' 0 C--O 1.232 0.151 0 C-N-CA 120.46 -0.496 . . . . 0.0 109.943 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -59.96 -50.32 74.21 Favored 'General case' 0 C--O 1.231 0.091 0 C-N-CA 120.664 -0.414 . . . . 0.0 110.438 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 97.1 mt -93.35 -78.24 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.187 179.542 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 176' ' ' GLY . . . . . 0.517 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 142.29 91.62 0.17 Allowed Glycine 0 CA--C 1.519 0.336 0 N-CA-C 111.441 -0.664 . . . . 0.0 111.441 179.779 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 32.7 ttp 66.83 107.6 0.04 OUTLIER 'General case' 0 CA--C 1.518 -0.268 0 CA-C-O 120.66 0.267 . . . . 0.0 110.905 179.169 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 178' ' ' GLU . . . . . 0.423 ' H ' ' H ' ' B' ' 179' ' ' GLN . 1.9 mt-10 174.63 12.43 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.618 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 179' ' ' GLN . . . . . 0.423 ' H ' ' H ' ' B' ' 178' ' ' GLU . 35.3 mt-30 -54.53 -38.14 66.22 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.61 -179.415 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 38.2 m -60.65 -48.29 82.43 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.855 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -57.08 -35.28 69.19 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.129 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 86.2 t -69.89 -53.37 24.31 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.774 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 77.6 p -57.14 -42.14 80.43 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.965 0.412 . . . . 0.0 110.572 -179.727 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 57.6 t-80 -63.92 -50.7 67.68 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-O 121.054 0.454 . . . . 0.0 110.794 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 85.6 mt-30 -62.3 -38.74 90.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.35 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 186' ' ' LEU . . . . . 0.451 HD21 ' CD1' ' B' ' 206' ' ' TYR . 58.1 tp -60.2 -45.14 94.18 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.219 -179.784 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 75.5 ttt180 -60.84 -44.45 96.95 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-O 121.135 0.493 . . . . 0.0 110.453 -179.572 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 88.9 t -66.74 -54.21 27.52 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.486 0 C-N-CA 120.121 -0.632 . . . . 0.0 110.709 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 97.7 mt -56.72 -41.32 77.25 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 -179.253 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 59.6 ttt85 -57.96 -39.97 79.42 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.237 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -61.19 -42.53 98.74 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 120.506 -0.478 . . . . 0.0 110.721 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 192' ' ' LEU . . . . . 0.495 HD23 ' N ' ' B' ' 192' ' ' LEU . 6.1 mt -66.96 -42.38 85.3 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.958 0.409 . . . . 0.0 110.5 -179.284 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 101.82 95.47 2.26 Favored Glycine 0 CA--C 1.524 0.647 0 N-CA-C 111.474 -0.65 . . . . 0.0 111.474 179.65 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 194' ' ' LEU . . . . . 0.413 ' H ' ' H ' ' B' ' 195' ' ' VAL . 0.5 OUTLIER -170.71 -7.93 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.924 0.393 . . . . 0.0 110.586 179.139 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 195' ' ' VAL . . . . . 0.413 ' H ' ' H ' ' B' ' 194' ' ' LEU . 22.4 m -136.79 156.11 34.45 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.08 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 196' ' ' VAL . . . . . 0.417 HG12 ' N ' ' B' ' 197' ' ' GLY . 66.5 t -143.53 155.34 16.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.39 -179.909 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 197' ' ' GLY . . . . . 0.417 ' N ' HG12 ' B' ' 196' ' ' VAL . . . -127.03 146.37 16.32 Favored Glycine 0 N--CA 1.463 0.484 0 N-CA-C 110.351 -1.099 . . . . 0.0 110.351 179.519 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 96.6 m-20 -103.32 116.37 32.3 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 120.606 0.241 . . . . 0.0 110.489 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 61.4 ttp180 -95.52 135.69 36.85 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.168 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 200' ' ' ALA . . . . . . . . . . . . . . . -145.4 94.79 2.56 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.503 -179.87 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 201' ' ' GLY . . . . . . . . . . . . . . . 61.8 -90.12 0.05 OUTLIER Glycine 0 CA--C 1.523 0.558 0 N-CA-C 110.629 -0.988 . . . . 0.0 110.629 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 202' ' ' ARG . . . . . . . . . . . . . 83.7 mtp180 -125.45 13.98 8.2 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.639 0.257 . . . . 0.0 110.66 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 43.1 m -119.93 111.67 18.22 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-O 120.926 0.393 . . . . 0.0 110.382 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 2.4 tp -120.21 130.2 74.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.948 179.61 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 23.5 m -122.01 158.86 25.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.429 178.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 206' ' ' TYR . . . . . 0.451 ' CD1' HD21 ' B' ' 186' ' ' LEU . 40.5 m-85 -114.22 137.63 51.53 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.646 -179.51 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 14.9 m -151.75 172.0 16.82 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.343 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 208' ' ' LEU . . . . . 0.615 ' N ' HD12 ' B' ' 208' ' ' LEU . 8.4 mp -75.79 148.11 38.7 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.555 179.763 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 67.5 t80 -52.71 -46.71 67.45 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.358 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 210' ' ' ASP . . . . . 0.518 ' CG ' ' H ' ' B' ' 211' ' ' THR . 43.5 t0 -157.01 -177.4 6.59 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.807 0.337 . . . . 0.0 110.505 -179.827 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 211' ' ' THR . . . . . 0.518 ' H ' ' CG ' ' B' ' 210' ' ' ASP . 4.8 t -77.09 4.77 9.48 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.483 -179.861 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 212' ' ' HIS . . . . . 0.4 ' O ' ' N ' ' B' ' 215' ' ' GLN . 35.1 m80 -60.35 -74.72 0.07 Allowed 'General case' 0 C--O 1.237 0.395 0 CA-C-O 121.016 0.436 . . . . 0.0 110.327 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 71.3 t -44.5 -39.82 1.78 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.352 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 214' ' ' ALA . . . . . . . . . . . . . . . -63.26 -39.4 94.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.501 179.816 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 215' ' ' GLN . . . . . 0.4 ' N ' ' O ' ' B' ' 212' ' ' HIS . 8.8 tp-100 -59.87 -47.51 85.44 Favored 'General case' 0 C--O 1.24 0.559 0 CA-C-O 121.146 0.498 . . . . 0.0 110.013 -179.521 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 216' ' ' LEU . . . . . 0.665 HD21 ' HA ' ' A' ' 101' ' ' ALA . 7.3 mp -62.75 -42.62 99.76 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.146 -179.548 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 6.5 tp -63.73 -38.74 92.23 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.085 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 64.0 t0 -57.81 -46.19 85.03 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.928 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 219' ' ' GLU . . . . . 0.527 ' OE1' ' N ' ' B' ' 219' ' ' GLU . 0.3 OUTLIER -64.76 -50.72 65.73 Favored 'General case' 0 N--CA 1.462 0.163 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.37 179.631 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 220' ' ' ALA . . . . . 0.649 ' HA ' HD21 ' A' ' 97' ' ' LEU . . . -57.75 -42.79 84.66 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 120.876 0.369 . . . . 0.0 110.565 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 4.1 mm -62.07 -44.36 98.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.6 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 80.2 t80 -62.22 -44.55 96.32 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.965 0.412 . . . . 0.0 110.324 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 223' ' ' HIS . . . . . . . . . . . . . 11.6 t-160 -56.29 -44.9 80.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.675 -179.799 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 27.2 t -75.55 -36.34 60.47 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.939 179.669 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 80.3 tt0 -56.81 -37.93 71.88 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.308 -179.399 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 226' ' ' HIS . . . . . 0.425 ' O ' ' O ' ' B' ' 227' ' ' LEU . 9.1 t60 -56.01 -71.81 0.08 Allowed 'General case' 0 C--N 1.332 -0.175 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.094 -179.467 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 227' ' ' LEU . . . . . 0.536 HD22 ' N ' ' B' ' 227' ' ' LEU . 4.1 mm? -56.88 -109.55 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.03 -179.634 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 228' ' ' HIS . . . . . 0.469 ' CG ' ' O ' ' B' ' 228' ' ' HIS . 82.9 t60 36.74 41.19 0.16 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.721 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 229' ' ' LEU . . . . . . . . . . . . . 1.8 pp -67.65 -34.39 76.85 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.534 -179.771 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . 145.3 41.06 0.05 OUTLIER Glycine 0 CA--C 1.523 0.533 0 N-CA-C 111.121 -0.792 . . . . 0.0 111.121 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 231' ' ' LEU . . . . . 0.451 ' C ' HD12 ' B' ' 231' ' ' LEU . 0.3 OUTLIER -99.81 -179.78 4.28 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 -179.985 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 232' ' ' SER . . . . . . . . . . . . . 70.4 m -110.12 114.37 27.81 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.469 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 233' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -64.49 -40.19 95.21 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.459 179.7 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 234' ' ' ARG . . . . . . . . . . . . . 7.9 ptm180 -142.38 136.89 30.04 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.113 0.482 . . . . 0.0 110.453 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 235' ' ' HIS . . . . . 0.57 ' N ' ' HD2' ' B' ' 236' ' ' PRO . 0.1 OUTLIER 170.06 -59.17 0.0 OUTLIER Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.013 -178.926 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 236' ' ' PRO . . . . . 0.57 ' HD2' ' N ' ' B' ' 235' ' ' HIS . 13.9 Cg_endo -55.26 -42.09 72.0 Favored 'Trans proline' 0 C--N 1.311 -1.42 0 C-N-CA 122.579 2.186 . . . . 0.0 111.818 -178.521 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 237' ' ' SER . . . . . . . . . . . . . 11.5 t -62.17 -44.55 96.36 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.467 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 238' ' ' ALA . . . . . . . . . . . . . . . -70.99 144.6 50.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.467 179.824 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.218 -0.849 0 CA-C-O 117.99 -1.45 . . . . 0.0 110.968 -179.965 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.219 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 17.7 p-80 -151.91 162.06 41.66 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.911 0.386 . . . . 0.0 110.557 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 56.18 102.04 0.01 OUTLIER Glycine 0 CA--C 1.524 0.65 0 N-CA-C 110.932 -0.867 . . . . 0.0 110.932 -180.0 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 11.9 p -62.37 -32.67 55.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.995 0.426 . . . . 0.0 110.71 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -61.32 -174.61 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.686 179.873 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -173.95 176.1 46.45 Favored Glycine 0 CA--C 1.524 0.599 0 N-CA-C 111.006 -0.838 . . . . 0.0 111.006 -179.887 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 89.0 mtm180 -79.83 57.89 2.69 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.757 0.313 . . . . 0.0 110.43 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 95.3 m-20 -62.52 -41.78 99.07 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.383 -179.837 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.896 ' H ' ' HE ' ' A' ' 10' ' ' ARG . 2.3 mmp_? 40.43 59.21 7.65 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.665 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -71.21 16.72 0.29 Allowed 'Trans proline' 0 C--N 1.306 -1.665 0 C-N-CA 122.717 2.278 . . . . 0.0 112.043 -179.444 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.441 ' H ' ' C ' ' A' ' 10' ' ' ARG . 73.9 p -119.0 7.02 11.33 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.822 -179.813 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.624 ' N ' ' CD ' ' A' ' 14' ' ' PRO . . . -73.6 -42.14 6.25 Favored Pre-proline 0 C--N 1.323 -0.567 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.684 179.325 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.624 ' CD ' ' N ' ' A' ' 13' ' ' ALA . 31.4 Cg_exo -57.84 141.91 96.05 Favored 'Trans proline' 0 C--N 1.312 -1.348 0 C-N-CA 122.61 2.207 . . . . 0.0 111.703 -179.057 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.523 ' O ' ' N ' ' A' ' 17' ' ' SER . 0.1 OUTLIER -107.26 -71.26 0.76 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.26 -179.93 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.429 ' C ' ' O ' ' A' ' 15' ' ' LEU . 97.2 m-20 -34.59 -31.28 0.01 OUTLIER 'General case' 0 C--N 1.339 0.151 0 O-C-N 123.469 0.481 . . . . 0.0 110.599 -179.25 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.523 ' N ' ' O ' ' A' ' 15' ' ' LEU . 88.7 p -44.09 -50.05 8.63 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 121.334 0.588 . . . . 0.0 110.066 179.216 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -63.91 -44.46 92.87 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.191 179.758 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.486 ' O ' HG23 ' A' ' 23' ' ' VAL . . . -57.39 -29.51 64.14 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.407 179.785 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -72.96 -50.58 22.51 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 120.885 0.374 . . . . 0.0 110.205 179.645 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.75 -41.98 95.5 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.912 179.731 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 72.6 tp60 -64.64 -52.94 54.73 Favored 'General case' 0 C--O 1.242 0.664 0 CA-C-O 121.255 0.55 . . . . 0.0 110.622 -179.399 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.486 HG23 ' O ' ' A' ' 19' ' ' ALA . 93.0 t -63.17 -45.94 97.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.994 -179.808 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -53.43 -43.17 67.8 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.195 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 49.2 m -59.9 -44.15 94.43 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.799 0.333 . . . . 0.0 110.47 179.852 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 95.6 m -63.8 -51.0 66.75 Favored 'General case' 0 C--O 1.238 0.478 0 C-N-CA 120.619 -0.432 . . . . 0.0 110.835 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.431 ' N ' ' CD1' ' A' ' 27' ' ' LEU . 7.8 mp -66.94 -19.77 65.78 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.703 179.77 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.475 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 55.8 tt0 -74.82 -59.91 2.52 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.636 179.4 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -57.12 -52.15 66.46 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.445 -179.566 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 97.0 mt -54.81 -39.75 68.81 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.226 -179.173 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.561 ' O ' ' C ' ' A' ' 32' ' ' THR . . . -40.25 -73.33 0.05 OUTLIER 'General case' 0 CA--C 1.514 -0.442 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.299 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.561 ' C ' ' O ' ' A' ' 31' ' ' ALA . 94.9 m -2.98 107.08 0.03 OUTLIER Pre-proline 0 CA--C 1.539 0.533 0 O-C-N 124.556 1.16 . . . . 0.0 111.098 -179.339 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -44.19 -50.37 7.79 Favored 'Trans proline' 0 C--N 1.308 -1.577 0 C-N-CA 122.289 1.993 . . . . 0.0 113.039 -177.378 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 10.0 t -58.39 -46.78 85.7 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.034 -179.527 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.437 ' HA ' HE22 ' A' ' 66' ' ' GLN . 50.6 ttm-85 -64.09 -43.66 94.73 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.388 -179.505 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.563 HD23 ' O ' ' A' ' 36' ' ' LEU . 2.1 tt -61.09 -52.26 65.66 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.468 -0.493 . . . . 0.0 110.545 -178.915 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 49.0 ttp -53.87 -47.0 71.48 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.737 -0.385 . . . . 0.0 110.754 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.498 HG21 ' OE1' ' A' ' 66' ' ' GLN . 88.1 mt -60.81 -47.71 92.04 Favored 'Isoleucine or valine' 0 C--O 1.239 0.534 0 CA-C-O 121.36 0.6 . . . . 0.0 110.687 -179.254 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -62.56 -41.06 98.68 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.691 179.682 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 75.4 m -59.21 -40.53 86.09 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.861 179.799 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 53.6 tp60 -61.55 -44.99 96.04 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.311 -0.404 . . . . 0.0 109.989 -179.852 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.443 ' O ' ' N ' ' A' ' 44' ' ' ASN . 9.7 mt -66.83 -24.29 66.14 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.971 179.634 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.432 ' C ' ' O ' ' A' ' 42' ' ' LEU . 72.1 ttp85 -33.78 -35.71 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 O-C-N 123.578 0.549 . . . . 0.0 111.063 -179.347 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.708 ' HB3' HD11 ' A' ' 47' ' ' LEU . 58.0 t-20 -62.2 -72.92 0.11 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.212 179.26 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.503 ' H ' ' CD1' ' A' ' 47' ' ' LEU . . . 153.74 -75.07 0.24 Allowed Glycine 0 CA--C 1.526 0.778 0 N-CA-C 111.206 -0.758 . . . . 0.0 111.206 179.515 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.773 ' C ' HD12 ' A' ' 47' ' ' LEU . 71.6 Cg_endo -81.19 98.53 1.03 Allowed 'Trans proline' 0 C--N 1.312 -1.377 0 C-N-CA 122.655 2.237 . . . . 0.0 112.349 179.108 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.773 HD12 ' C ' ' A' ' 46' ' ' PRO . 5.1 mp -145.61 69.4 13.62 Favored Pre-proline 0 N--CA 1.465 0.28 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.236 179.475 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_exo -45.81 163.89 0.08 OUTLIER 'Trans proline' 0 C--N 1.308 -1.575 0 C-N-CA 122.563 2.175 . . . . 0.0 112.038 179.681 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 91.5 t -54.4 -47.07 70.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 121.129 0.49 . . . . 0.0 110.373 -178.927 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 66.4 p -63.98 -34.81 78.83 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.454 179.301 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -67.62 -39.94 84.68 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.807 179.879 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 16.5 mt -62.89 -40.01 96.22 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.925 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.569 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -59.67 -48.1 83.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.982 -0.554 . . . . 0.0 109.533 179.384 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 42.6 tp10 -56.91 -46.04 82.23 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.549 -0.46 . . . . 0.0 109.991 179.915 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -63.38 -51.21 66.8 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 120.73 -0.388 . . . . 0.0 110.662 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 97.5 mt -81.28 -71.0 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.519 -180.0 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' GLY . . . . . 0.569 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 130.53 75.01 0.14 Allowed Glycine 0 N--CA 1.463 0.449 0 N-CA-C 111.206 -0.757 . . . . 0.0 111.206 179.546 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 8.8 ttp 73.87 103.07 0.07 Allowed 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 120.993 -0.283 . . . . 0.0 110.848 179.343 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 179.89 17.68 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.383 179.608 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.411 ' HG3' ' H ' ' A' ' 60' ' ' GLN . 39.4 mt-30 -51.75 -32.09 29.21 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.8 -179.349 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 50.9 m -66.8 -43.56 83.59 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.91 179.845 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.87 -30.66 71.73 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.252 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 75.1 t -72.78 -52.84 20.94 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.235 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.579 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 69.4 m -56.35 -45.33 80.48 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.416 -179.292 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 62.9 m-70 -62.87 -49.73 73.68 Favored 'General case' 0 C--O 1.239 0.501 0 CA-C-O 121.214 0.531 . . . . 0.0 111.004 179.786 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.498 ' OE1' HG21 ' A' ' 38' ' ' ILE . 51.2 tt0 -62.49 -38.73 91.01 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.233 -179.742 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.5 tt -61.57 -43.34 99.04 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.646 -179.937 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -61.69 -42.02 98.37 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.934 -0.306 . . . . 0.0 110.616 179.77 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 89.2 t -64.48 -55.04 23.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 C-N-CA 120.135 -0.626 . . . . 0.0 110.678 -179.614 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 10.8 mp -61.73 -41.04 97.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.961 0.41 . . . . 0.0 110.132 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 79.0 ttt-85 -56.19 -41.72 76.01 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.094 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 8.2 t-20 -58.25 -49.89 75.51 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.6 -0.44 . . . . 0.0 110.228 -179.563 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.546 HD22 ' N ' ' A' ' 73' ' ' LEU . 4.0 mm? -68.09 -41.64 81.55 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.816 179.29 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 105.12 43.24 1.66 Allowed Glycine 0 CA--C 1.524 0.648 0 N-CA-C 111.076 -0.81 . . . . 0.0 111.076 -179.776 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.489 ' N ' HD12 ' A' ' 75' ' ' LEU . 9.0 mp -97.4 -15.22 20.77 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 110.448 -0.204 . . . . 0.0 110.448 179.378 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 30.5 m -136.83 160.22 36.95 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.344 0 CA-C-O 120.801 0.334 . . . . 0.0 110.334 -179.85 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.422 HG12 ' N ' ' A' ' 78' ' ' GLY . 51.5 t -140.16 155.48 23.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.356 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.422 ' N ' HG12 ' A' ' 77' ' ' VAL . . . -126.66 149.67 17.64 Favored Glycine 0 CA--C 1.521 0.431 0 N-CA-C 110.515 -1.034 . . . . 0.0 110.515 179.612 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -113.64 107.87 16.36 Favored 'General case' 0 C--O 1.236 0.388 0 N-CA-C 110.256 -0.276 . . . . 0.0 110.256 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 15.1 tpt180 -73.5 132.05 42.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.595 -179.674 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -145.83 94.61 2.51 Favored 'General case' 0 CA--C 1.522 -0.119 0 CA-C-O 120.784 0.326 . . . . 0.0 110.328 179.874 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 58.32 -118.46 13.55 Favored Glycine 0 CA--C 1.522 0.491 0 N-CA-C 110.839 -0.904 . . . . 0.0 110.839 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 84.2 mtt85 -98.8 17.31 19.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.614 0.245 . . . . 0.0 110.725 179.879 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 2.5 t -139.66 142.82 36.95 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-O 120.942 0.401 . . . . 0.0 110.554 -179.606 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.447 ' CD1' ' CE1' ' A' ' 87' ' ' TYR . 0.0 OUTLIER -138.79 145.2 28.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.501 179.748 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 77.3 t -114.13 134.45 56.97 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.653 -179.651 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.447 ' CE1' ' CD1' ' A' ' 85' ' ' ILE . 84.2 m-85 -99.51 130.02 45.72 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.198 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 31.3 p -146.01 165.77 28.03 Favored 'General case' 0 C--O 1.224 -0.263 0 N-CA-C 109.816 -0.439 . . . . 0.0 109.816 -179.379 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.624 ' N ' HD12 ' A' ' 89' ' ' LEU . 8.0 mp -67.53 147.5 52.72 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.369 -179.416 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 61.3 t80 -50.55 -42.38 55.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.426 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 46.8 p30 -146.71 179.68 7.4 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.508 -0.315 . . . . 0.0 110.4 -179.937 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' THR . . . . . 0.595 ' O ' ' HB3' ' A' ' 95' ' ' ALA . 28.1 m -95.27 -17.65 21.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.499 -179.898 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 92.2 m-70 -40.97 -66.1 0.36 Allowed 'General case' 0 C--O 1.235 0.322 0 CA-C-O 121.368 0.604 . . . . 0.0 110.964 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 8.3 p -47.5 -34.89 3.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.347 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.595 ' HB3' ' O ' ' A' ' 92' ' ' THR . . . -64.08 -39.75 94.73 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.303 179.569 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -59.47 -45.43 91.66 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.919 -179.773 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.697 HD21 ' HA ' ' B' ' 220' ' ' ALA . 8.3 mp -60.74 -44.15 97.03 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.336 -0.546 . . . . 0.0 109.875 -179.315 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.558 HD11 HD21 ' A' ' 36' ' ' LEU . 6.1 tp -64.8 -38.33 90.62 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.526 179.521 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 63.9 t0 -57.05 -46.57 82.32 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.984 -179.487 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -70.32 -47.86 59.2 Favored 'General case' 0 C--O 1.232 0.152 0 C-N-CA 120.566 -0.454 . . . . 0.0 110.105 179.82 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.679 ' HA ' HD21 ' B' ' 216' ' ' LEU . . . -53.46 -47.87 69.35 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.461 179.602 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 4.3 mm -63.09 -44.59 99.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 C-N-CA 120.626 -0.43 . . . . 0.0 110.64 -179.511 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 86.5 t80 -60.37 -41.42 93.68 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.018 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' HIS . . . . . 0.521 ' CE1' HD12 ' A' ' 108' ' ' LEU . 64.7 t60 -69.28 -39.85 78.1 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.716 179.61 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.489 ' O ' ' N ' ' A' ' 109' ' ' HIS . 48.3 t -57.86 -47.82 81.59 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.544 -178.965 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 0.479 ' C ' ' N ' ' A' ' 108' ' ' LEU . 98.3 mt-10 -76.89 -54.45 6.58 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.94 0.4 . . . . 0.0 111.411 179.212 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 83.6 t60 -48.75 -13.11 0.05 OUTLIER 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.268 -178.762 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.521 HD12 ' CE1' ' A' ' 104' ' ' HIS . 64.2 mt -142.92 -74.39 0.28 Allowed 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.801 179.737 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 109' ' ' HIS . . . . . 0.489 ' N ' ' O ' ' A' ' 105' ' ' SER . 15.2 t-80 78.37 74.67 0.06 Allowed 'General case' 0 C--N 1.33 -0.264 0 O-C-N 123.45 0.469 . . . . 0.0 110.488 -179.827 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.621 ' N ' HD12 ' A' ' 110' ' ' LEU . 9.6 mp -63.08 -42.82 99.72 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.888 0.375 . . . . 0.0 110.27 -179.543 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 69.01 129.03 0.05 OUTLIER Glycine 0 CA--C 1.524 0.636 0 N-CA-C 111.159 -0.777 . . . . 0.0 111.159 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 2.2 pp -156.96 141.32 16.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.9 0.381 . . . . 0.0 110.522 179.739 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 25.8 t -164.04 41.59 0.09 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.456 -179.839 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 52.9 p-10 -82.38 169.79 16.05 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.472 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 88.8 mtm180 -75.46 149.66 38.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.651 -179.826 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 69.0 m-70 -45.18 150.45 0.79 Allowed Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.628 -179.544 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -66.34 -24.15 50.67 Favored 'Trans proline' 0 N--CA 1.495 1.57 0 C-N-CA 122.611 2.207 . . . . 0.0 112.096 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 48.5 t 47.25 -107.21 0.17 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.584 -179.646 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . 49.28 -161.37 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.586 -179.907 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.766 0 CA-C-O 118.063 -1.409 . . . . 0.0 110.922 179.965 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.272 0 N-CA-C 109.505 -1.438 . . . . 0.0 109.505 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 18.0 p-80 -151.56 160.63 43.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.842 0.353 . . . . 0.0 110.54 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 123' ' ' GLY . . . . . . . . . . . . . . . 57.01 101.62 0.01 OUTLIER Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.986 -0.846 . . . . 0.0 110.986 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 12.2 p -62.04 -32.49 54.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.024 0.44 . . . . 0.0 110.716 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 125' ' ' GLU . . . . . . . . . . . . . 94.8 mt-10 -60.53 -171.7 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.798 179.72 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -176.93 178.14 48.16 Favored Glycine 0 CA--C 1.523 0.586 0 N-CA-C 110.975 -0.85 . . . . 0.0 110.975 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 127' ' ' ARG . . . . . . . . . . . . . 89.6 mtm180 -82.21 58.06 3.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.823 0.344 . . . . 0.0 110.571 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 128' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 -62.7 -42.32 99.58 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.573 -179.88 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 129' ' ' ARG . . . . . 0.866 ' H ' ' HE ' ' B' ' 129' ' ' ARG . 2.8 mmp_? 41.07 59.43 8.4 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.607 179.93 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -71.37 14.81 0.36 Allowed 'Trans proline' 0 C--N 1.308 -1.58 0 C-N-CA 122.661 2.241 . . . . 0.0 112.123 -179.589 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 131' ' ' SER . . . . . 0.417 ' H ' ' C ' ' B' ' 129' ' ' ARG . 83.2 p -116.71 5.62 13.18 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.883 -179.832 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 132' ' ' ALA . . . . . 0.619 ' N ' ' CD ' ' B' ' 133' ' ' PRO . . . -72.79 -41.86 7.39 Favored Pre-proline 0 C--N 1.322 -0.624 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.575 179.255 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 133' ' ' PRO . . . . . 0.619 ' CD ' ' N ' ' B' ' 132' ' ' ALA . 32.0 Cg_exo -57.44 140.76 94.15 Favored 'Trans proline' 0 C--N 1.311 -1.436 0 C-N-CA 122.678 2.252 . . . . 0.0 111.631 -179.046 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 134' ' ' LEU . . . . . 0.511 ' O ' ' N ' ' B' ' 136' ' ' SER . 0.1 OUTLIER -106.46 -71.53 0.75 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.072 -179.997 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 135' ' ' ASP . . . . . 0.43 ' C ' ' O ' ' B' ' 134' ' ' LEU . 98.0 m-20 -34.68 -30.94 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.19 0 O-C-N 123.48 0.488 . . . . 0.0 110.591 -179.231 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 136' ' ' SER . . . . . 0.511 ' N ' ' O ' ' B' ' 134' ' ' LEU . 83.4 p -44.51 -50.89 9.28 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.231 179.303 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -63.48 -44.01 95.65 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.235 179.861 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 138' ' ' ALA . . . . . 0.428 ' O ' HG23 ' B' ' 142' ' ' VAL . . . -57.73 -29.35 64.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.383 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -72.62 -50.33 26.02 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 121.106 0.479 . . . . 0.0 110.222 179.497 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -65.01 -40.94 95.64 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.724 179.67 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 66.1 tp60 -65.19 -53.59 42.35 Favored 'General case' 0 C--O 1.241 0.62 0 CA-C-O 121.272 0.558 . . . . 0.0 110.761 -179.298 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 142' ' ' VAL . . . . . 0.428 HG23 ' O ' ' B' ' 138' ' ' ALA . 92.6 t -62.97 -46.47 96.24 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.881 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -52.25 -43.67 64.48 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.229 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 51.0 m -59.88 -44.2 94.32 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.4 179.797 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 22.8 m -63.08 -51.76 65.37 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 120.493 -0.483 . . . . 0.0 111.065 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 146' ' ' LEU . . . . . 0.453 ' N ' ' CD1' ' B' ' 146' ' ' LEU . 7.7 mp -66.82 -19.79 65.81 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.667 179.761 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 147' ' ' GLN . . . . . 0.445 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 57.8 tt0 -74.38 -61.01 2.01 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.62 179.548 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -56.58 -51.63 67.9 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.631 -179.524 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.403 ' O ' ' C ' ' B' ' 150' ' ' ALA . 97.1 mt -55.2 -39.97 70.24 Favored 'General case' 0 CA--C 1.515 -0.386 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.307 -179.105 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 150' ' ' ALA . . . . . 0.558 ' O ' ' C ' ' B' ' 151' ' ' THR . . . -40.18 -73.94 0.04 OUTLIER 'General case' 0 CA--C 1.513 -0.464 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.262 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 151' ' ' THR . . . . . 0.558 ' C ' ' O ' ' B' ' 150' ' ' ALA . 92.4 m -2.24 106.87 0.03 OUTLIER Pre-proline 0 CA--C 1.539 0.528 0 O-C-N 124.627 1.204 . . . . 0.0 110.994 -179.333 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -43.72 -50.54 7.04 Favored 'Trans proline' 0 C--N 1.307 -1.638 0 C-N-CA 122.231 1.954 . . . . 0.0 112.977 -177.169 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 11.1 t -58.56 -46.32 87.13 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.985 -179.344 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 50.6 ttm-85 -63.68 -44.65 93.1 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 120.708 -0.397 . . . . 0.0 110.526 -179.497 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 155' ' ' LEU . . . . . 0.611 HD21 HD11 ' B' ' 217' ' ' LEU . 1.6 tt -60.88 -51.41 69.42 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.543 -0.463 . . . . 0.0 110.464 -178.972 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 50.4 ttp -54.07 -47.53 71.59 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.583 -0.447 . . . . 0.0 110.942 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 157' ' ' ILE . . . . . 0.491 HG21 ' OE1' ' B' ' 185' ' ' GLN . 90.5 mt -61.1 -47.51 93.24 Favored 'Isoleucine or valine' 0 C--O 1.239 0.526 0 CA-C-O 121.228 0.537 . . . . 0.0 110.58 -179.326 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -62.51 -41.16 98.66 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.654 179.467 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 159' ' ' THR . . . . . 0.435 ' OG1' ' CD2' ' B' ' 155' ' ' LEU . 18.6 m -59.37 -40.11 85.43 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.813 179.718 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 56.4 tp60 -61.6 -45.23 94.98 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.061 0.458 . . . . 0.0 109.921 -179.71 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 161' ' ' LEU . . . . . 0.438 ' O ' ' N ' ' B' ' 163' ' ' ASN . 9.5 mt -66.39 -23.84 66.39 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.96 179.702 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 162' ' ' ARG . . . . . 0.436 ' C ' ' O ' ' B' ' 161' ' ' LEU . 72.1 ttp85 -34.05 -35.54 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 O-C-N 123.533 0.521 . . . . 0.0 111.114 -179.214 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 163' ' ' ASN . . . . . 0.676 ' HB3' HD11 ' B' ' 166' ' ' LEU . 58.8 t-20 -61.77 -71.41 0.15 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.26 179.382 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 164' ' ' GLY . . . . . 0.479 ' H ' ' CD1' ' B' ' 166' ' ' LEU . . . 153.36 -76.33 0.22 Allowed Glycine 0 CA--C 1.527 0.822 0 N-CA-C 111.157 -0.777 . . . . 0.0 111.157 179.545 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 165' ' ' PRO . . . . . 0.792 ' C ' HD12 ' B' ' 166' ' ' LEU . 74.3 Cg_endo -82.08 101.74 1.16 Allowed 'Trans proline' 0 N--CA 1.492 1.391 0 C-N-CA 122.605 2.203 . . . . 0.0 112.182 179.174 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 166' ' ' LEU . . . . . 0.792 HD12 ' C ' ' B' ' 165' ' ' PRO . 5.3 mp -146.61 69.76 12.44 Favored Pre-proline 0 N--CA 1.464 0.246 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.397 179.666 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_exo -45.57 163.09 0.09 OUTLIER 'Trans proline' 0 C--N 1.307 -1.614 0 C-N-CA 122.52 2.147 . . . . 0.0 112.049 179.431 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . 87.6 t -53.85 -46.79 64.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 121.099 0.476 . . . . 0.0 110.402 -179.195 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 169' ' ' THR . . . . . . . . . . . . . 64.2 p -63.94 -35.46 80.74 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.472 179.374 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -66.79 -40.14 88.02 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.095 179.621 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 16.5 mt -63.12 -40.55 97.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.137 179.884 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 172' ' ' ALA . . . . . 0.577 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -59.06 -47.86 83.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.487 179.48 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 42.3 tp10 -57.02 -45.93 82.74 Favored 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 120.46 -0.496 . . . . 0.0 110.029 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -63.31 -49.72 72.89 Favored 'General case' 0 C--O 1.231 0.103 0 C-N-CA 120.669 -0.412 . . . . 0.0 110.717 -179.851 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 96.3 mt -82.62 -71.16 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.432 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 176' ' ' GLY . . . . . 0.577 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 129.8 74.25 0.14 Allowed Glycine 0 N--CA 1.463 0.476 0 N-CA-C 111.205 -0.758 . . . . 0.0 111.205 179.419 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 177' ' ' MET . . . . . 0.421 ' CB ' ' O ' ' B' ' 176' ' ' GLY . 3.4 tmm? 75.43 102.08 0.07 Allowed 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 120.668 -0.413 . . . . 0.0 110.879 179.407 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 179.26 18.08 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.335 179.679 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -52.5 -32.01 38.1 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.651 -179.299 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 47.0 m -66.4 -43.44 85.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.921 0.391 . . . . 0.0 110.903 179.72 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -63.92 -30.77 71.83 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.365 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 94.5 t -72.78 -52.86 20.83 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.244 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.777 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 74.3 m -56.49 -45.49 80.95 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.456 -179.48 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 58.6 m-70 -62.22 -48.91 77.89 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.111 0.481 . . . . 0.0 110.661 179.789 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 185' ' ' GLN . . . . . 0.491 ' OE1' HG21 ' B' ' 157' ' ' ILE . 50.6 tt0 -62.9 -39.72 95.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.262 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 5.4 tt -61.05 -43.31 99.07 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.559 -179.722 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -61.81 -42.36 98.92 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 120.979 -0.288 . . . . 0.0 110.687 179.712 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 99.4 t -64.18 -54.89 25.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 C-N-CA 120.158 -0.617 . . . . 0.0 110.691 -179.663 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 10.6 mp -61.75 -41.08 97.2 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.81 0.338 . . . . 0.0 110.164 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 79.5 ttt-85 -54.91 -42.52 72.3 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.156 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -57.82 -50.48 73.13 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.504 -0.478 . . . . 0.0 110.335 -179.683 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 192' ' ' LEU . . . . . 0.534 ' N ' HD22 ' B' ' 192' ' ' LEU . 3.9 mm? -66.76 -42.91 85.4 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.851 0.358 . . . . 0.0 110.853 179.496 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 105.77 42.14 1.74 Allowed Glycine 0 CA--C 1.525 0.717 0 N-CA-C 111.154 -0.778 . . . . 0.0 111.154 -179.881 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 194' ' ' LEU . . . . . 0.487 ' N ' HD12 ' B' ' 194' ' ' LEU . 8.1 mp -96.46 -15.1 21.92 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 120.496 0.189 . . . . 0.0 110.682 179.643 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 29.4 m -138.27 161.92 30.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.773 0.321 . . . . 0.0 110.269 -179.771 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 196' ' ' VAL . . . . . 0.461 HG12 ' N ' ' B' ' 197' ' ' GLY . 61.9 t -141.87 157.99 20.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.535 179.42 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 197' ' ' GLY . . . . . 0.461 ' N ' HG12 ' B' ' 196' ' ' VAL . . . -129.53 149.38 18.66 Favored Glycine 0 CA--C 1.521 0.447 0 N-CA-C 110.625 -0.99 . . . . 0.0 110.625 179.437 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 198' ' ' ASP . . . . . 0.408 ' O ' HD12 ' B' ' 204' ' ' ILE . 17.8 t70 -112.48 110.66 20.98 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-O 120.863 0.363 . . . . 0.0 110.709 -179.711 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 14.4 tpt180 -75.52 128.52 35.49 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.472 179.837 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 200' ' ' ALA . . . . . . . . . . . . . . . -142.14 95.22 2.77 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.531 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 201' ' ' GLY . . . . . . . . . . . . . . . 58.42 -113.05 4.48 Favored Glycine 0 CA--C 1.524 0.599 0 N-CA-C 110.627 -0.989 . . . . 0.0 110.627 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 202' ' ' ARG . . . . . . . . . . . . . 84.8 mtt85 -106.36 23.85 13.48 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.653 0.263 . . . . 0.0 110.577 179.696 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 8.2 t -138.97 130.78 27.64 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-O 120.899 0.38 . . . . 0.0 110.188 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 204' ' ' ILE . . . . . 0.408 HD12 ' O ' ' B' ' 198' ' ' ASP . 1.2 tp -121.46 128.03 75.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.901 179.429 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 70.7 t -104.41 130.61 54.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.033 -0.53 . . . . 0.0 109.77 178.63 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 77.0 m-85 -102.59 132.7 48.51 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.468 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 36.1 p -150.07 169.26 21.65 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.029 -179.413 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 208' ' ' LEU . . . . . 0.619 ' N ' HD12 ' B' ' 208' ' ' LEU . 7.8 mp -68.78 149.18 49.29 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.566 -179.28 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 59.3 t80 -53.46 -43.81 68.42 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.547 179.709 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 40.7 p30 -144.47 179.9 6.97 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.42 -179.801 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 211' ' ' THR . . . . . 0.59 ' O ' ' HB3' ' B' ' 214' ' ' ALA . 25.4 m -96.16 -17.8 20.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.596 -179.92 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 212' ' ' HIS . . . . . . . . . . . . . 89.4 m-70 -40.77 -65.82 0.38 Allowed 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 121.38 0.61 . . . . 0.0 110.706 179.674 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 7.5 p -47.57 -34.45 3.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.345 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 214' ' ' ALA . . . . . 0.59 ' HB3' ' O ' ' B' ' 211' ' ' THR . . . -65.45 -38.25 89.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.08 179.491 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -60.89 -45.57 94.1 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.032 -179.772 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 216' ' ' LEU . . . . . 0.679 HD21 ' HA ' ' A' ' 101' ' ' ALA . 8.2 mp -61.09 -43.72 98.45 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.445 -0.502 . . . . 0.0 109.712 -179.579 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 217' ' ' LEU . . . . . 0.611 HD11 HD21 ' B' ' 155' ' ' LEU . 7.1 tp -64.47 -40.21 95.27 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.461 179.309 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 65.7 t0 -56.44 -46.31 80.35 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.028 -179.49 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 219' ' ' GLU . . . . . . . . . . . . . 16.7 tp10 -70.13 -48.94 55.36 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.146 179.724 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 220' ' ' ALA . . . . . 0.697 ' HA ' HD21 ' A' ' 97' ' ' LEU . . . -53.22 -47.53 68.89 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.331 179.584 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 4.5 mm -62.99 -44.6 99.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.597 -179.71 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 90.0 t80 -60.02 -42.82 95.18 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.985 -179.794 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 223' ' ' HIS . . . . . 0.483 ' CE1' HD12 ' B' ' 227' ' ' LEU . 47.8 t60 -68.41 -38.69 81.48 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.619 179.247 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 224' ' ' SER . . . . . 0.491 ' O ' ' N ' ' B' ' 228' ' ' HIS . 11.5 t -57.41 -48.78 78.19 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.648 -178.827 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 225' ' ' GLU . . . . . 0.457 ' C ' ' N ' ' B' ' 227' ' ' LEU . 96.0 mt-10 -77.14 -53.19 8.07 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.958 0.408 . . . . 0.0 111.428 179.111 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 86.2 t60 -49.05 -13.51 0.06 Allowed 'General case' 0 CA--C 1.518 -0.261 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.274 -178.794 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 227' ' ' LEU . . . . . 0.483 HD12 ' CE1' ' B' ' 223' ' ' HIS . 61.8 mt -142.72 -72.87 0.3 Allowed 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.9 179.917 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 228' ' ' HIS . . . . . 0.491 ' N ' ' O ' ' B' ' 224' ' ' SER . 20.3 t-80 75.97 74.57 0.09 Allowed 'General case' 0 C--N 1.328 -0.337 0 O-C-N 123.506 0.504 . . . . 0.0 110.427 -179.762 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 229' ' ' LEU . . . . . 0.543 ' N ' HD12 ' B' ' 229' ' ' LEU . 10.5 mp -62.9 -42.37 99.76 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.498 -179.761 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . 69.37 131.31 0.06 OUTLIER Glycine 0 CA--C 1.525 0.712 0 N-CA-C 110.922 -0.871 . . . . 0.0 110.922 -179.849 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 231' ' ' LEU . . . . . . . . . . . . . 2.2 pp -159.68 140.25 12.15 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.814 0.34 . . . . 0.0 110.586 179.902 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 232' ' ' SER . . . . . . . . . . . . . 39.8 t -163.05 43.26 0.12 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.356 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 233' ' ' ASP . . . . . . . . . . . . . 54.3 p-10 -83.27 169.91 15.2 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.588 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 234' ' ' ARG . . . . . . . . . . . . . 88.1 mtm180 -76.6 150.02 36.51 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.692 -179.865 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 235' ' ' HIS . . . . . . . . . . . . . 69.9 m-70 -44.94 149.73 0.81 Allowed Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.69 -179.361 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 236' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -66.05 -22.48 54.83 Favored 'Trans proline' 0 N--CA 1.493 1.478 0 C-N-CA 122.697 2.264 . . . . 0.0 112.096 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 237' ' ' SER . . . . . . . . . . . . . 47.5 t 46.4 -108.25 0.18 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.585 -179.693 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 238' ' ' ALA . . . . . . . . . . . . . . . 49.56 -160.11 0.06 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.581 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.745 0 CA-C-O 118.041 -1.421 . . . . 0.0 110.918 179.978 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.428 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 61.5 m170 -63.03 -44.89 94.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.732 0.301 . . . . 0.0 110.433 -179.813 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -83.15 -128.62 1.34 Allowed Glycine 0 CA--C 1.521 0.467 0 N-CA-C 110.69 -0.964 . . . . 0.0 110.69 179.864 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 33.9 m -127.88 132.85 68.4 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-O 120.777 0.322 . . . . 0.0 110.445 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 45.1 tt0 -89.73 124.32 34.52 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.367 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -88.34 118.29 5.05 Favored Glycine 0 CA--C 1.524 0.641 0 N-CA-C 110.756 -0.938 . . . . 0.0 110.756 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 88.6 mtm180 -78.64 144.08 35.76 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.678 0.275 . . . . 0.0 110.496 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.513 ' C ' ' HE ' ' A' ' 10' ' ' ARG . 18.7 p30 -81.59 133.89 35.43 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.561 -179.981 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.513 ' HE ' ' C ' ' A' ' 9' ' ' ASN . 0.0 OUTLIER -73.46 151.71 89.66 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.658 -179.495 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -67.98 154.75 71.96 Favored 'Trans proline' 0 C--N 1.309 -1.535 0 C-N-CA 122.722 2.281 . . . . 0.0 111.995 179.444 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 7.1 m -52.62 106.15 0.15 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.444 179.823 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -165.67 60.65 0.68 Allowed Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.432 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -72.83 41.38 0.54 Allowed 'Trans proline' 0 C--N 1.309 -1.549 0 C-N-CA 122.785 2.323 . . . . 0.0 111.938 -179.808 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.552 ' O ' ' N ' ' A' ' 17' ' ' SER . 71.0 mt -74.86 141.99 44.17 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.269 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.406 ' C ' ' O ' ' A' ' 15' ' ' LEU . 97.7 m-20 -35.64 -26.86 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.27 0 O-C-N 123.467 0.48 . . . . 0.0 110.645 -179.822 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.552 ' N ' ' O ' ' A' ' 15' ' ' LEU . 11.4 t -56.43 -48.16 77.55 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-O 121.362 0.601 . . . . 0.0 109.723 179.338 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.439 ' N ' ' O ' ' A' ' 15' ' ' LEU . 90.7 mm-40 -65.3 -47.48 76.45 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.02 179.42 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.712 ' O ' HG23 ' A' ' 23' ' ' VAL . . . -56.31 -29.12 60.82 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.237 -179.896 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -71.28 -49.71 40.2 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 120.867 -0.333 . . . . 0.0 110.152 179.554 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.25 -44.01 95.62 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.525 179.908 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -59.4 -49.36 78.09 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-O 121.162 0.506 . . . . 0.0 110.352 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.712 HG23 ' O ' ' A' ' 19' ' ' ALA . 84.4 t -61.71 -44.26 98.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.025 179.626 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.505 ' HB1' ' N ' ' B' ' 151' ' ' THR . . . -57.78 -41.9 82.99 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 120.876 0.37 . . . . 0.0 110.032 179.868 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 48.3 t -58.76 -44.84 90.69 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.021 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.453 ' OG1' ' O ' ' A' ' 23' ' ' VAL . 71.3 p -64.42 -47.28 79.73 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 120.989 0.423 . . . . 0.0 110.566 179.362 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 95.1 mt -63.95 -23.77 67.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.406 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.494 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 54.9 tt0 -75.65 -56.49 4.64 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.733 179.542 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.65 -55.1 39.38 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.786 -179.333 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.478 ' O ' ' O ' ' A' ' 31' ' ' ALA . 3.8 mm? -46.8 -35.14 5.92 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 -179.18 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.494 ' HB3' ' O ' ' A' ' 28' ' ' GLN . . . -55.07 -161.92 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.064 -0.517 . . . . 0.0 109.858 179.428 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.549 ' CB ' HH11 ' A' ' 35' ' ' ARG . 1.0 OUTLIER 81.86 114.41 0.03 OUTLIER Pre-proline 0 C--N 1.323 -0.544 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.182 179.827 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -49.19 -42.6 39.34 Favored 'Trans proline' 0 N--CA 1.496 1.641 0 C-N-CA 122.265 1.977 . . . . 0.0 112.957 -179.14 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 47.4 t -59.36 -45.54 91.11 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.881 -179.191 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.549 HH11 ' CB ' ' A' ' 32' ' ' THR . 84.6 mtt85 -62.03 -44.31 96.98 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.738 -0.385 . . . . 0.0 111.186 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -61.3 -47.59 85.27 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.476 -0.49 . . . . 0.0 110.96 -179.52 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.435 ' O ' ' OE1' ' A' ' 41' ' ' GLN . 20.2 ttm -56.54 -48.95 76.19 Favored 'General case' 0 C--N 1.319 -0.743 0 C-N-CA 120.285 -0.566 . . . . 0.0 110.301 -179.804 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 37.8 mm -63.5 -43.66 98.45 Favored 'Isoleucine or valine' 0 C--O 1.234 0.256 0 CA-C-O 121.045 0.45 . . . . 0.0 110.44 -179.752 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 mt -62.15 -39.75 93.66 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.456 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 18.0 m -60.55 -43.72 96.9 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.101 -0.5 . . . . 0.0 109.981 179.796 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.435 ' OE1' ' O ' ' A' ' 37' ' ' MET . 3.4 mp0 -61.31 -44.9 96.44 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.985 0.422 . . . . 0.0 110.041 179.809 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 97.9 mt -61.79 -40.23 94.47 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.066 -179.434 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.536 ' NH2' ' OD2' ' A' ' 99' ' ' ASP . 20.3 tpt180 -63.72 -37.67 88.21 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.951 179.974 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -56.95 -42.33 79.91 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.692 -178.54 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 169.38 -174.49 43.77 Favored Glycine 0 CA--C 1.527 0.786 0 N-CA-C 111.007 -0.837 . . . . 0.0 111.007 179.724 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -77.83 122.34 5.83 Favored 'Trans proline' 0 C--N 1.311 -1.408 0 C-N-CA 122.819 2.346 . . . . 0.0 111.663 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.441 ' H ' HD12 ' A' ' 47' ' ' LEU . 0.2 OUTLIER -150.16 95.89 3.55 Favored Pre-proline 0 CA--C 1.537 0.451 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.961 -179.248 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_exo -47.06 173.22 0.03 OUTLIER 'Trans proline' 0 C--N 1.306 -1.664 0 C-N-CA 122.495 2.13 . . . . 0.0 112.284 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 73.0 t -54.64 -45.02 72.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.433 -179.23 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 15.3 m -59.78 -40.24 87.62 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.22 0.533 . . . . 0.0 110.255 179.208 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 56.3 t0 -65.71 -38.98 90.68 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.16 179.517 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.6 ' O ' HD13 ' A' ' 52' ' ' LEU . 0.3 OUTLIER -62.46 -44.19 97.0 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-O 121.308 0.575 . . . . 0.0 110.028 -179.565 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.497 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -55.87 -48.44 75.57 Favored 'General case' 0 N--CA 1.444 -0.738 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 179.707 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 44.9 tp10 -56.48 -48.43 77.14 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.318 -0.553 . . . . 0.0 110.549 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -54.29 -58.07 8.8 Favored 'General case' 0 C--N 1.332 -0.163 0 C-N-CA 120.896 -0.322 . . . . 0.0 110.614 -179.467 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 90.6 mt -86.35 -73.16 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.417 179.775 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' GLY . . . . . 0.497 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 131.88 98.09 0.72 Allowed Glycine 0 N--CA 1.461 0.316 0 N-CA-C 111.055 -0.818 . . . . 0.0 111.055 -179.679 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 64.3 mtt 66.48 99.54 0.05 OUTLIER 'General case' 0 C--N 1.34 0.18 0 CA-C-O 120.767 0.317 . . . . 0.0 110.722 178.889 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.41 ' H ' ' H ' ' A' ' 60' ' ' GLN . 2.1 mt-10 -179.53 15.12 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.359 179.864 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.41 ' H ' ' H ' ' A' ' 59' ' ' GLU . 52.0 mt-30 -55.54 -36.9 67.29 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.549 -179.372 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 78.1 p -62.09 -49.29 76.53 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.821 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.34 -35.87 72.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.278 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 75.8 t -67.19 -52.95 37.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.596 -179.694 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 10.4 t -56.84 -42.29 79.38 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.248 -179.416 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -63.17 -49.8 72.88 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.816 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 86.6 mm-40 -63.72 -41.17 98.12 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.594 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.8 tp -62.52 -44.66 95.82 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.359 -179.679 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 70.4 mmt-85 -62.43 -42.42 99.44 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.848 0.356 . . . . 0.0 110.66 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 71.9 t -67.23 -54.37 24.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 C-N-CA 120.262 -0.575 . . . . 0.0 110.468 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 92.4 mt -58.49 -41.4 85.24 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.063 -179.323 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 73.5 ttt180 -58.55 -41.67 86.14 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.405 179.729 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 93.3 m-20 -57.65 -50.39 73.32 Favored 'General case' 0 C--N 1.332 -0.171 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.455 -179.421 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.8 mt -67.7 -40.76 84.3 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.934 0.397 . . . . 0.0 110.407 -179.887 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 103.09 78.76 1.31 Allowed Glycine 0 CA--C 1.52 0.398 0 N-CA-C 110.872 -0.891 . . . . 0.0 110.872 -179.644 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.424 HD11 HG21 ' A' ' 94' ' ' VAL . 6.7 tp -144.9 -9.35 0.61 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.943 0.401 . . . . 0.0 110.793 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 33.8 m -139.05 158.34 29.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.454 -179.859 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.476 HG12 ' N ' ' A' ' 78' ' ' GLY . 48.4 t -143.99 157.69 15.87 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.577 -179.793 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.476 ' N ' HG12 ' A' ' 77' ' ' VAL . . . -134.44 144.48 16.45 Favored Glycine 0 CA--C 1.521 0.463 0 N-CA-C 110.388 -1.085 . . . . 0.0 110.388 179.623 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 46.9 t0 -103.51 106.54 17.08 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 120.919 0.39 . . . . 0.0 110.343 179.519 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -80.9 132.46 35.44 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.674 179.874 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.593 ' C ' ' H ' ' A' ' 83' ' ' ARG . . . -131.13 147.68 52.64 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.352 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -65.59 33.92 0.13 Allowed Glycine 0 CA--C 1.527 0.82 0 N-CA-C 111.16 -0.776 . . . . 0.0 111.16 -179.827 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.593 ' H ' ' C ' ' A' ' 81' ' ' ALA . 8.3 ptp85 -157.26 -26.05 0.09 Allowed 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 120.687 0.279 . . . . 0.0 110.261 179.965 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' SER . . . . . 0.414 ' OG ' ' O ' ' A' ' 83' ' ' ARG . 18.5 m -173.91 167.43 4.33 Favored 'General case' 0 CA--C 1.518 -0.287 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 -179.727 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -122.41 130.03 74.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.901 179.262 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 46.6 t -109.16 133.12 55.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.218 178.855 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -106.88 131.47 53.93 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.288 179.749 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.435 ' O ' ' O ' ' A' ' 77' ' ' VAL . 99.9 p -150.09 166.88 28.42 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.487 ' O ' ' N ' ' A' ' 91' ' ' ASP . 0.3 OUTLIER -78.9 154.16 29.93 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.175 -179.361 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.402 ' CE2' ' OG1' ' A' ' 92' ' ' THR . 71.0 t80 -46.17 -15.55 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.434 179.688 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.487 ' N ' ' O ' ' A' ' 89' ' ' LEU . 52.8 t0 41.94 89.81 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.189 179.055 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' THR . . . . . 0.459 ' OG1' ' O ' ' A' ' 91' ' ' ASP . 2.1 m -169.58 -133.8 0.02 OUTLIER 'General case' 0 C--O 1.236 0.353 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.56 179.656 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' HIS . . . . . 0.444 ' H ' HG22 ' A' ' 92' ' ' THR . 40.4 m80 -55.08 -53.06 60.65 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.021 -179.89 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.424 HG21 HD11 ' A' ' 75' ' ' LEU . 95.3 t -49.78 -39.53 14.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.245 179.754 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.52 -41.44 98.86 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.485 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 58.6 tt0 -60.65 -46.34 90.71 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.006 0.432 . . . . 0.0 110.11 -179.865 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.463 HD11 ' N ' ' B' ' 220' ' ' ALA . 3.7 mm? -62.32 -43.14 99.52 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.433 179.677 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.504 ' O ' HG22 ' A' ' 102' ' ' ILE . 62.3 tp -65.06 -39.29 93.07 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.422 179.869 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' ASP . . . . . 0.536 ' OD2' ' NH2' ' A' ' 43' ' ' ARG . 94.2 m-20 -62.71 -39.84 95.27 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.154 0.502 . . . . 0.0 110.839 -178.983 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.464 ' OE2' ' OE2' ' B' ' 219' ' ' GLU . 97.5 mt-10 -74.16 -52.62 11.93 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.825 179.67 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.447 ' N ' HD11 ' B' ' 216' ' ' LEU . . . -57.89 -48.37 80.06 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.965 -179.629 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.561 HG23 ' N ' ' A' ' 103' ' ' TYR . 10.4 tp -64.73 -46.1 93.2 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 CA-C-O 120.892 0.377 . . . . 0.0 111.111 -179.096 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 103' ' ' TYR . . . . . 0.561 ' N ' HG23 ' A' ' 102' ' ' ILE . 91.0 t80 -62.98 -43.97 97.31 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.783 -179.422 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 3.4 m-70 -67.31 -41.44 85.32 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.756 -179.734 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 6.4 t -67.93 -44.29 77.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.977 0.417 . . . . 0.0 110.744 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 15.1 tm-20 -67.63 -29.2 68.46 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.569 -179.811 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' HIS . . . . . 0.535 ' O ' ' N ' ' A' ' 109' ' ' HIS . 18.7 t60 -51.37 -67.85 0.22 Allowed 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.262 -178.946 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.498 ' N ' HD22 ' A' ' 108' ' ' LEU . 4.4 mm? -41.3 91.11 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.027 0.441 . . . . 0.0 110.401 -179.779 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 109' ' ' HIS . . . . . 0.535 ' N ' ' O ' ' A' ' 107' ' ' HIS . 82.5 t60 -107.75 125.19 51.11 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.567 179.847 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.645 ' N ' HD12 ' A' ' 110' ' ' LEU . 9.3 mp -62.33 -42.75 99.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.295 -179.382 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 111' ' ' GLY . . . . . 0.411 ' O ' ' O ' ' A' ' 110' ' ' LEU . . . 57.9 114.6 0.01 OUTLIER Glycine 0 CA--C 1.526 0.727 0 N-CA-C 110.775 -0.93 . . . . 0.0 110.775 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.642 HD12 ' N ' ' A' ' 112' ' ' LEU . 8.8 mp 54.71 41.54 31.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.768 0.318 . . . . 0.0 110.418 179.901 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 14.9 m 51.76 -96.63 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.405 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 42.4 p30 -153.88 -173.58 4.63 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.709 -179.735 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 79.3 mtp85 -62.15 -39.86 94.04 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.201 -179.829 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 3.1 m-70 -62.05 149.89 85.07 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.607 -179.651 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -66.63 128.52 19.22 Favored 'Trans proline' 0 N--CA 1.494 1.522 0 C-N-CA 122.511 2.141 . . . . 0.0 111.995 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 43.0 t -63.08 -44.1 96.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.555 179.483 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -167.4 154.53 8.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.639 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.671 0 CA-C-O 118.052 -1.416 . . . . 0.0 110.963 179.896 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.172 0 N-CA-C 109.579 -1.408 . . . . 0.0 109.579 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 54.7 m170 -61.31 -45.2 95.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.728 0.299 . . . . 0.0 110.609 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 123' ' ' GLY . . . . . . . . . . . . . . . -85.83 -118.18 0.97 Allowed Glycine 0 CA--C 1.523 0.532 0 N-CA-C 110.62 -0.992 . . . . 0.0 110.62 179.783 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 20.5 m -132.46 151.25 34.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 120.802 0.335 . . . . 0.0 110.326 179.682 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 125' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -108.43 120.4 42.28 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.456 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -82.95 117.65 4.45 Favored Glycine 0 CA--C 1.525 0.66 0 N-CA-C 110.723 -0.951 . . . . 0.0 110.723 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 127' ' ' ARG . . . . . . . . . . . . . 89.9 mtm180 -80.09 139.33 36.92 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.775 0.321 . . . . 0.0 110.519 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 128' ' ' ASN . . . . . 0.567 ' C ' ' HE ' ' B' ' 129' ' ' ARG . 22.0 p30 -75.9 134.2 40.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.586 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 129' ' ' ARG . . . . . 0.567 ' HE ' ' C ' ' B' ' 128' ' ' ASN . 0.0 OUTLIER -75.19 151.67 85.91 Favored Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.495 -179.603 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -67.57 152.98 77.59 Favored 'Trans proline' 0 N--CA 1.494 1.516 0 C-N-CA 122.642 2.228 . . . . 0.0 112.107 179.432 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 33.3 m -50.82 103.21 0.05 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.347 179.806 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 132' ' ' ALA . . . . . . . . . . . . . . . -161.52 58.26 0.91 Allowed Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.502 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 133' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -71.45 41.79 0.44 Allowed 'Trans proline' 0 N--CA 1.494 1.555 0 C-N-CA 122.823 2.348 . . . . 0.0 111.926 -179.81 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 134' ' ' LEU . . . . . 0.557 ' O ' ' N ' ' B' ' 136' ' ' SER . 61.0 mt -76.57 142.67 40.69 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.283 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 135' ' ' ASP . . . . . 0.408 ' C ' ' O ' ' B' ' 134' ' ' LEU . 98.9 m-20 -34.97 -28.01 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.255 0 O-C-N 123.496 0.497 . . . . 0.0 110.639 -179.851 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 136' ' ' SER . . . . . 0.557 ' N ' ' O ' ' B' ' 134' ' ' LEU . 9.9 t -55.15 -48.68 73.38 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.236 0.541 . . . . 0.0 109.788 179.514 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 137' ' ' GLN . . . . . 0.414 ' N ' ' O ' ' B' ' 134' ' ' LEU . 95.6 mm-40 -65.36 -47.6 75.88 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.937 179.535 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 138' ' ' ALA . . . . . 0.609 ' O ' HG23 ' B' ' 142' ' ' VAL . . . -56.02 -29.81 60.93 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.196 -179.837 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -71.28 -49.88 38.34 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 120.888 0.375 . . . . 0.0 110.156 179.653 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -61.1 -41.14 96.12 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.529 179.953 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -61.21 -49.86 75.45 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-O 121.214 0.531 . . . . 0.0 110.427 179.71 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 142' ' ' VAL . . . . . 0.609 HG23 ' O ' ' B' ' 138' ' ' ALA . 93.5 t -61.78 -44.46 98.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.145 179.697 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 143' ' ' ALA . . . . . 0.477 ' HB1' ' N ' ' A' ' 32' ' ' THR . . . -57.01 -42.19 79.88 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 120.804 0.335 . . . . 0.0 110.167 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 14.0 t -58.71 -44.97 90.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.98 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 77.5 p -64.2 -46.36 84.27 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 120.967 0.413 . . . . 0.0 110.451 179.466 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 95.4 mt -64.51 -23.4 67.26 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.435 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 147' ' ' GLN . . . . . 0.484 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 57.1 tt0 -75.64 -56.36 4.76 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.785 179.527 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -59.12 -55.2 38.03 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.766 -179.393 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.467 ' O ' ' O ' ' B' ' 150' ' ' ALA . 3.8 mm? -46.66 -36.38 6.99 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 -179.127 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 150' ' ' ALA . . . . . 0.484 ' HB3' ' O ' ' B' ' 147' ' ' GLN . . . -54.86 -162.2 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.927 179.602 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 151' ' ' THR . . . . . 0.562 ' CB ' HH11 ' B' ' 154' ' ' ARG . 0.6 OUTLIER 82.79 115.07 0.03 OUTLIER Pre-proline 0 CA--C 1.54 0.564 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.294 179.694 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -48.98 -42.68 37.74 Favored 'Trans proline' 0 N--CA 1.496 1.618 0 C-N-CA 122.18 1.92 . . . . 0.0 113.063 -179.303 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 39.6 t -60.16 -45.97 91.28 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.976 -179.131 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 154' ' ' ARG . . . . . 0.562 HH11 ' CB ' ' B' ' 151' ' ' THR . 84.4 mtt85 -62.56 -43.6 98.41 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.125 -179.722 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 155' ' ' LEU . . . . . 0.415 HD13 ' HA ' ' B' ' 155' ' ' LEU . 4.2 mm? -62.69 -47.0 85.52 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.72 -0.392 . . . . 0.0 111.036 -179.479 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 36.4 ttp -58.34 -48.92 79.01 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.266 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 35.3 mm -63.28 -43.84 98.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 121.054 0.454 . . . . 0.0 110.371 179.76 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 36.9 mt -61.5 -40.68 95.48 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.222 -179.709 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 19.9 m -59.97 -45.14 93.66 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.005 179.694 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -58.03 -45.1 87.5 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.676 -0.41 . . . . 0.0 109.991 179.864 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 161' ' ' LEU . . . . . . . . . . . . . 97.0 mt -62.03 -40.07 94.47 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.122 0.486 . . . . 0.0 109.996 -179.47 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 162' ' ' ARG . . . . . 0.548 ' NH2' ' OD2' ' B' ' 218' ' ' ASP . 21.5 tpt180 -63.52 -37.99 89.41 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.951 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 98.4 m-20 -56.57 -42.09 78.04 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.588 -178.64 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . 169.43 -175.91 43.56 Favored Glycine 0 CA--C 1.528 0.876 0 N-CA-C 110.997 -0.841 . . . . 0.0 110.997 179.665 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -76.99 123.26 6.66 Favored 'Trans proline' 0 N--CA 1.492 1.413 0 C-N-CA 122.856 2.371 . . . . 0.0 111.593 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 166' ' ' LEU . . . . . 0.449 ' H ' HD12 ' B' ' 166' ' ' LEU . 0.2 OUTLIER -150.61 96.38 3.39 Favored Pre-proline 0 CA--C 1.538 0.504 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.016 -179.238 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_exo -47.06 173.31 0.03 OUTLIER 'Trans proline' 0 C--N 1.306 -1.71 0 C-N-CA 122.456 2.104 . . . . 0.0 112.309 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . 81.7 t -54.77 -45.2 73.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.43 -179.292 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 169' ' ' THR . . . . . . . . . . . . . 15.7 m -59.99 -40.28 88.61 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.186 0.517 . . . . 0.0 110.229 179.199 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -65.45 -38.64 90.45 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.191 179.297 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 171' ' ' LEU . . . . . 0.597 ' O ' HD13 ' B' ' 171' ' ' LEU . 0.3 OUTLIER -62.63 -44.82 95.33 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.272 0.558 . . . . 0.0 110.011 -179.587 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 172' ' ' ALA . . . . . 0.486 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -55.66 -48.07 75.64 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 179.782 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 43.6 tp10 -56.04 -48.39 76.07 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.308 -0.557 . . . . 0.0 110.502 179.767 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -54.82 -58.35 7.93 Favored 'General case' 0 C--N 1.333 -0.136 0 C-N-CA 120.749 -0.38 . . . . 0.0 110.776 -179.511 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 87.7 mt -86.62 -72.98 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.454 179.847 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 176' ' ' GLY . . . . . 0.486 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 130.54 99.41 0.84 Allowed Glycine 0 N--CA 1.461 0.323 0 N-CA-C 111.119 -0.792 . . . . 0.0 111.119 -179.779 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 62.5 mtt 66.27 95.71 0.06 Allowed 'General case' 0 CA--C 1.521 -0.172 0 CA-C-O 120.887 0.375 . . . . 0.0 110.745 178.79 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -176.71 14.65 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.404 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 54.8 mt-30 -55.79 -37.07 68.11 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.64 -179.247 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 64.3 p -61.49 -48.43 81.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.036 -179.726 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -59.2 -35.4 73.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.233 -179.902 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 97.5 t -67.12 -52.91 38.38 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.101 0 C-N-CA 120.467 -0.493 . . . . 0.0 110.726 -179.713 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 10.7 t -57.11 -42.18 80.33 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.289 -179.576 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 86.0 t60 -63.42 -50.27 70.48 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.905 -179.904 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 90.6 mm-40 -63.69 -40.48 96.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.949 0.404 . . . . 0.0 110.668 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 8.6 tp -62.52 -44.94 95.13 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.403 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 73.1 mmt-85 -62.46 -42.31 99.38 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.746 -179.761 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 77.7 t -66.34 -54.58 24.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 C-N-CA 120.179 -0.608 . . . . 0.0 110.506 -179.741 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 87.2 mt -58.83 -41.15 86.19 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 -179.251 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 71.8 ttt180 -57.95 -41.37 82.69 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.272 179.704 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 -59.82 -49.87 76.03 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 120.488 -0.485 . . . . 0.0 110.447 -179.33 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 192' ' ' LEU . . . . . 0.4 ' N ' HD23 ' B' ' 192' ' ' LEU . 9.2 mt -67.55 -39.41 84.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.816 0.341 . . . . 0.0 110.464 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 101.28 80.98 1.54 Allowed Glycine 0 N--CA 1.462 0.42 0 N-CA-C 110.727 -0.949 . . . . 0.0 110.727 -179.639 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 194' ' ' LEU . . . . . 0.419 HD21 HD11 ' B' ' 149' ' ' LEU . 4.9 tp -147.47 -9.68 0.42 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.777 0.322 . . . . 0.0 110.768 -179.932 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 26.7 m -140.05 159.18 26.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.412 -179.636 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 196' ' ' VAL . . . . . 0.515 HG12 ' N ' ' B' ' 197' ' ' GLY . 47.7 t -145.62 159.62 12.46 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.493 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 197' ' ' GLY . . . . . 0.515 ' N ' HG12 ' B' ' 196' ' ' VAL . . . -135.68 145.21 17.22 Favored Glycine 0 CA--C 1.523 0.563 0 N-CA-C 110.409 -1.077 . . . . 0.0 110.409 179.615 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 67.3 t0 -103.21 106.21 16.67 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 120.868 0.366 . . . . 0.0 110.337 179.564 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 3.4 tmt_? -80.57 134.81 35.97 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.562 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 200' ' ' ALA . . . . . 0.595 ' C ' ' H ' ' B' ' 202' ' ' ARG . . . -133.25 148.42 51.98 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.407 -179.934 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 201' ' ' GLY . . . . . . . . . . . . . . . -65.38 31.08 0.12 Allowed Glycine 0 CA--C 1.524 0.655 0 N-CA-C 111.21 -0.756 . . . . 0.0 111.21 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 202' ' ' ARG . . . . . 0.595 ' H ' ' C ' ' B' ' 200' ' ' ALA . 8.1 ptp85 -153.08 -27.06 0.15 Allowed 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 110.246 -0.279 . . . . 0.0 110.246 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 19.0 m -174.45 169.46 3.73 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 -179.633 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 1.3 tp -122.77 132.26 71.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.021 179.352 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 47.2 t -111.74 132.55 60.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.179 178.951 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 96.3 m-85 -106.07 131.97 52.7 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.417 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 207' ' ' SER . . . . . 0.443 ' O ' ' O ' ' B' ' 196' ' ' VAL . 40.6 p -150.52 167.26 27.72 Favored 'General case' 0 CA--C 1.52 -0.196 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 208' ' ' LEU . . . . . 0.475 ' O ' HD12 ' B' ' 208' ' ' LEU . 0.3 OUTLIER -78.97 154.12 29.81 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.224 -179.158 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 66.4 t80 -46.36 -15.85 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.805 0.336 . . . . 0.0 110.529 179.647 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 210' ' ' ASP . . . . . 0.473 ' N ' ' O ' ' B' ' 208' ' ' LEU . 35.5 t0 42.45 89.72 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.21 179.107 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 211' ' ' THR . . . . . 0.489 HG22 ' H ' ' B' ' 212' ' ' HIS . 2.3 m -169.32 -134.77 0.02 OUTLIER 'General case' 0 C--O 1.238 0.47 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.471 179.634 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 212' ' ' HIS . . . . . 0.489 ' H ' HG22 ' B' ' 211' ' ' THR . 40.4 m80 -55.36 -53.51 55.3 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.02 -179.904 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 92.9 t -48.9 -38.88 11.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.214 179.741 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 214' ' ' ALA . . . . . . . . . . . . . . . -63.26 -42.24 99.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.347 179.831 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 58.8 tt0 -58.78 -46.62 87.1 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.073 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 216' ' ' LEU . . . . . 0.457 ' CD2' ' N ' ' B' ' 216' ' ' LEU . 3.5 mm? -61.99 -42.69 99.42 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.441 179.647 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 217' ' ' LEU . . . . . 0.476 ' O ' HG22 ' B' ' 221' ' ' ILE . 58.1 tp -65.4 -39.97 92.83 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.509 179.75 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 218' ' ' ASP . . . . . 0.548 ' OD2' ' NH2' ' B' ' 162' ' ' ARG . 98.8 m-20 -62.46 -40.16 95.74 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.163 0.506 . . . . 0.0 110.975 -178.941 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 219' ' ' GLU . . . . . 0.464 ' OE2' ' OE2' ' A' ' 100' ' ' GLU . 97.0 mt-10 -74.36 -53.45 9.62 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.807 179.564 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 220' ' ' ALA . . . . . 0.463 ' N ' HD11 ' A' ' 97' ' ' LEU . . . -56.8 -48.75 77.25 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.852 -179.305 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 221' ' ' ILE . . . . . 0.54 HG23 ' N ' ' B' ' 222' ' ' TYR . 3.8 tp -64.94 -45.76 93.77 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 C-N-CA 120.571 -0.452 . . . . 0.0 111.11 -179.174 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 222' ' ' TYR . . . . . 0.54 ' N ' HG23 ' B' ' 221' ' ' ILE . 90.4 t80 -62.36 -43.75 98.09 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.547 -179.46 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 223' ' ' HIS . . . . . . . . . . . . . 2.9 m-70 -67.47 -41.45 84.58 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.7 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 6.2 t -68.02 -44.5 76.37 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.915 0.388 . . . . 0.0 110.834 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 15.3 tm-20 -67.81 -28.78 67.87 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.664 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 226' ' ' HIS . . . . . 0.516 ' O ' ' N ' ' B' ' 228' ' ' HIS . 15.7 t60 -51.26 -68.03 0.2 Allowed 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.263 -178.987 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 227' ' ' LEU . . . . . 0.484 HD22 ' N ' ' B' ' 227' ' ' LEU . 4.4 mm? -41.68 92.66 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.079 0.466 . . . . 0.0 110.386 -179.821 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 228' ' ' HIS . . . . . 0.516 ' N ' ' O ' ' B' ' 226' ' ' HIS . 85.4 t60 -108.5 125.3 51.64 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.599 179.765 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 229' ' ' LEU . . . . . 0.54 ' N ' HD12 ' B' ' 229' ' ' LEU . 10.8 mp -61.81 -41.94 98.39 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.209 -179.602 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 230' ' ' GLY . . . . . 0.41 ' O ' ' O ' ' B' ' 229' ' ' LEU . . . 57.29 113.34 0.01 OUTLIER Glycine 0 CA--C 1.524 0.646 0 N-CA-C 110.899 -0.88 . . . . 0.0 110.899 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 231' ' ' LEU . . . . . 0.625 ' N ' HD12 ' B' ' 231' ' ' LEU . 8.7 mp 54.92 41.76 31.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.805 0.336 . . . . 0.0 110.485 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 232' ' ' SER . . . . . . . . . . . . . 30.8 m 52.41 -98.77 0.07 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.558 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 233' ' ' ASP . . . . . . . . . . . . . 50.2 p30 -152.35 -174.93 5.06 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.583 -179.752 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 234' ' ' ARG . . . . . . . . . . . . . 79.0 mtp85 -60.43 -41.67 94.5 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.422 -179.908 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 235' ' ' HIS . . . . . . . . . . . . . 2.6 m-70 -60.5 150.27 74.67 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.761 -179.63 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 236' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -66.86 128.59 19.1 Favored 'Trans proline' 0 N--CA 1.494 1.516 0 C-N-CA 122.52 2.146 . . . . 0.0 112.038 179.684 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 237' ' ' SER . . . . . . . . . . . . . 42.0 t -63.37 -44.07 95.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.516 179.653 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 238' ' ' ALA . . . . . . . . . . . . . . . -166.97 154.15 8.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.536 -179.859 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.72 0 CA-C-O 118.041 -1.422 . . . . 0.0 110.937 179.897 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.261 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.413 ' O ' ' ND1' ' A' ' 3' ' ' HIS . 49.7 t-80 47.91 41.54 14.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.817 0.341 . . . . 0.0 110.538 -179.979 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -176.7 -178.57 46.56 Favored Glycine 0 CA--C 1.521 0.442 0 N-CA-C 110.815 -0.914 . . . . 0.0 110.815 179.953 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 33.7 m -120.83 131.02 73.95 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 CA-C-O 120.853 0.359 . . . . 0.0 110.57 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 72.8 mm-40 -61.59 -64.81 0.82 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.55 -179.879 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 146.0 149.28 4.96 Favored Glycine 0 CA--C 1.524 0.611 0 N-CA-C 110.894 -0.882 . . . . 0.0 110.894 179.774 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 84.6 mtt85 -64.92 -41.32 95.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.86 0.362 . . . . 0.0 110.636 179.83 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 90.8 m-20 52.83 56.72 7.2 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.689 179.74 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 85.8 mtm180 -68.64 147.93 98.03 Favored Pre-proline 0 N--CA 1.452 -0.357 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.755 -179.464 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -70.54 146.57 55.74 Favored 'Trans proline' 0 C--N 1.309 -1.522 0 C-N-CA 122.698 2.265 . . . . 0.0 111.956 179.583 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 40.7 t -106.58 95.76 5.97 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.481 179.472 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -168.35 149.41 4.59 Favored Pre-proline 0 N--CA 1.45 -0.473 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.813 179.609 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -66.89 143.48 66.74 Favored 'Trans proline' 0 C--N 1.31 -1.453 0 C-N-CA 122.784 2.322 . . . . 0.0 111.736 179.594 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.841 HD23 ' H ' ' A' ' 15' ' ' LEU . 1.1 pt? -105.48 2.27 28.38 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.72 179.635 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.454 ' C ' ' O ' ' A' ' 15' ' ' LEU . 22.8 p-10 -33.48 -45.43 0.16 Allowed 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.948 0.404 . . . . 0.0 110.673 -179.121 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 78.3 p -54.74 -49.69 70.19 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.299 178.926 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.534 ' N ' ' O ' ' A' ' 15' ' ' LEU . 11.1 tp-100 -62.44 -45.1 94.59 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.308 -0.405 . . . . 0.0 109.909 179.808 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.557 ' O ' HG23 ' A' ' 23' ' ' VAL . . . -57.14 -29.41 63.56 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.377 179.914 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -72.72 -51.73 18.04 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 121.201 0.524 . . . . 0.0 110.416 179.547 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.2 -41.08 97.23 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.954 179.76 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 59.4 tt0 -64.92 -53.3 48.68 Favored 'General case' 0 C--O 1.241 0.654 0 CA-C-O 121.279 0.561 . . . . 0.0 110.902 -179.412 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.557 HG23 ' O ' ' A' ' 19' ' ' ALA . 96.6 t -61.56 -44.29 98.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.183 179.633 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -54.71 -42.53 71.61 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 179.714 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.6 t -58.81 -44.77 90.89 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 179.736 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 12.0 m -63.3 -45.73 90.0 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.26 179.024 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 95.7 mt -64.85 -22.28 66.96 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.523 179.717 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.524 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 58.1 tt0 -74.77 -55.66 5.6 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.425 179.49 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.66 -55.58 33.31 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.375 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.509 ' O ' ' O ' ' A' ' 31' ' ' ALA . 89.9 mt -44.94 -34.64 2.49 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.312 -179.565 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.524 ' HB3' ' O ' ' A' ' 28' ' ' GLN . . . -56.41 -139.97 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 O-C-N 123.517 0.511 . . . . 0.0 110.568 179.152 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.456 ' O ' ' O ' ' A' ' 31' ' ' ALA . 85.4 m 57.23 115.3 0.02 OUTLIER Pre-proline 0 C--N 1.323 -0.575 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.547 179.784 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -49.55 -46.76 25.41 Favored 'Trans proline' 0 N--CA 1.493 1.465 0 C-N-CA 122.371 2.047 . . . . 0.0 112.722 -179.337 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 57.9 m -62.87 -46.82 86.05 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.307 -178.876 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.2 tpp180 -63.01 -47.62 82.3 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.448 -178.824 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.584 HD23 ' O ' ' A' ' 36' ' ' LEU . 3.2 tt -60.38 -53.27 59.56 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.439 -178.636 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 62.1 ttp -50.77 -48.3 59.37 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-O 120.909 0.385 . . . . 0.0 110.167 179.776 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 5.5 mm -62.26 -43.83 98.44 Favored 'Isoleucine or valine' 0 C--O 1.239 0.519 0 CA-C-O 121.091 0.472 . . . . 0.0 110.525 179.501 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 14.3 mt -61.79 -41.11 97.32 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.288 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 9.8 m -58.36 -40.44 82.26 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.01 -0.541 . . . . 0.0 109.672 179.539 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 50.5 mt-30 -61.85 -44.28 97.15 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.469 179.499 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.517 ' O ' ' N ' ' A' ' 44' ' ' ASN . 80.5 mt -63.46 -31.57 72.76 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.127 179.472 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.548 HH21 ' CG ' ' A' ' 99' ' ' ASP . 33.4 tpt85 -33.9 -32.5 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 O-C-N 123.534 0.521 . . . . 0.0 110.866 -179.593 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.517 ' N ' ' O ' ' A' ' 42' ' ' LEU . 81.2 m-20 -72.44 -84.22 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.43 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 149.73 -76.37 0.24 Allowed Glycine 0 CA--C 1.527 0.82 0 N-CA-C 110.882 -0.887 . . . . 0.0 110.882 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -68.71 84.25 0.51 Allowed 'Trans proline' 0 C--N 1.307 -1.652 0 C-N-CA 122.742 2.294 . . . . 0.0 112.328 -179.379 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -156.9 68.07 4.33 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-O 121.045 0.45 . . . . 0.0 110.108 -179.747 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_exo -45.07 170.52 0.02 OUTLIER 'Trans proline' 0 C--N 1.298 -2.107 0 C-N-CA 122.416 2.078 . . . . 0.0 112.168 -179.837 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 80.8 t -54.32 -45.44 68.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.335 -179.593 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 15.1 m -61.34 -39.23 89.8 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.16 0.505 . . . . 0.0 110.292 179.117 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -66.31 -41.29 89.9 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.106 179.686 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.616 ' O ' HD13 ' A' ' 52' ' ' LEU . 0.2 OUTLIER -61.77 -42.58 99.17 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.775 -179.764 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.577 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -56.37 -47.78 78.19 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 179.323 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -54.64 -45.27 73.75 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.686 -0.406 . . . . 0.0 109.939 179.639 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -55.52 -57.59 11.27 Favored 'General case' 0 C--N 1.333 -0.139 0 C-N-CA 120.763 -0.375 . . . . 0.0 110.649 179.687 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 95.3 mt -80.48 -69.11 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.389 179.36 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' GLY . . . . . 0.577 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 131.95 75.93 0.12 Allowed Glycine 0 CA--C 1.521 0.438 0 N-CA-C 110.931 -0.868 . . . . 0.0 110.931 179.817 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.438 ' CB ' ' O ' ' A' ' 57' ' ' GLY . 1.1 tmm? 77.72 95.91 0.06 Allowed 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.708 179.581 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 19.9 tp10 -174.06 34.25 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.18 179.754 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -69.63 -20.91 63.59 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.957 -179.291 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 77.9 p -69.17 -43.55 74.03 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.958 -179.679 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.25 -35.79 81.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.266 179.764 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 87.0 t -66.97 -51.84 50.35 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.232 0 C-N-CA 120.727 -0.389 . . . . 0.0 110.433 -179.729 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 51.7 m -55.24 -44.04 75.14 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.53 -0.468 . . . . 0.0 110.358 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' HIS . . . . . 0.408 ' O ' HG22 ' A' ' 69' ' ' VAL . 33.7 m80 -68.42 -44.1 75.73 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.033 179.733 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 64.9 mt-30 -60.77 -40.62 93.18 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.381 -179.693 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -68.06 -39.85 82.88 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 120.975 0.417 . . . . 0.0 110.561 179.141 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 17.5 tpt85 -58.81 -47.19 85.64 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.617 -178.916 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.605 HG23 ' N ' ' A' ' 70' ' ' LEU . 27.6 m -75.24 -53.05 17.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.525 179.902 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.605 ' N ' HG23 ' A' ' 69' ' ' VAL . 69.5 mt -52.94 -38.97 62.5 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 -179.612 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 78.4 ttt180 -68.45 -42.37 78.91 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.481 178.919 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 9.1 m120 -60.08 -52.41 65.47 Favored 'General case' 0 C--N 1.333 -0.126 0 C-N-CA 120.646 -0.422 . . . . 0.0 110.426 -179.476 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.535 HD22 ' N ' ' A' ' 73' ' ' LEU . 3.9 mm? -67.28 -39.95 86.09 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.679 178.954 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 96.61 98.55 1.89 Allowed Glycine 0 CA--C 1.523 0.575 0 N-CA-C 110.938 -0.865 . . . . 0.0 110.938 -179.493 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.9 tp -163.05 -7.39 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.816 0.341 . . . . 0.0 110.76 179.869 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 33.6 m -140.61 163.37 22.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.271 -179.867 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.403 HG23 ' CD2' ' A' ' 90' ' ' TYR . 37.1 t -139.96 154.39 23.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.443 179.796 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -143.45 152.2 23.91 Favored Glycine 0 CA--C 1.522 0.486 0 N-CA-C 110.802 -0.919 . . . . 0.0 110.802 179.323 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ASP . . . . . 0.452 ' OD1' ' N ' ' A' ' 79' ' ' ASP . 3.9 p-10 -133.08 107.18 8.07 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.667 0.27 . . . . 0.0 110.327 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 62.2 ttp180 -88.39 136.6 32.91 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.575 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -139.95 94.9 2.82 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.375 179.43 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 64.17 -115.7 8.21 Favored Glycine 0 CA--C 1.524 0.599 0 N-CA-C 110.395 -1.082 . . . . 0.0 110.395 -179.887 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 44.0 mmm-85 -94.83 -2.85 50.02 Favored 'General case' 0 C--N 1.33 -0.282 0 O-C-N 122.884 -0.186 . . . . 0.0 110.542 179.708 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' SER . . . . . 0.402 ' O ' ' HB ' ' A' ' 85' ' ' ILE . 12.6 p -104.11 178.21 4.62 Favored 'General case' 0 CA--C 1.513 -0.456 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 179.899 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.504 HD11 ' CD2' ' A' ' 87' ' ' TYR . 0.0 OUTLIER 176.91 153.51 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 123.706 0.629 . . . . 0.0 110.682 179.636 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.466 ' N ' HD13 ' A' ' 85' ' ' ILE . 48.0 t -136.24 124.74 36.68 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.225 0 CA-C-O 120.858 0.361 . . . . 0.0 111.066 178.486 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.504 ' CD2' HD11 ' A' ' 85' ' ' ILE . 8.6 m-85 -108.27 126.08 52.41 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.076 178.904 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 38.6 m -148.65 166.72 27.49 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.365 -179.832 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 10.8 mt -61.65 152.42 30.85 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.272 -179.464 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.403 ' CD2' HG23 ' A' ' 77' ' ' VAL . 6.9 t80 -54.6 -49.43 70.48 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.43 -179.349 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 81.5 m-20 -130.99 -180.0 5.66 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 121.018 0.437 . . . . 0.0 110.373 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' THR . . . . . 0.586 ' O ' ' HB3' ' A' ' 95' ' ' ALA . 19.1 m -95.37 -18.15 20.99 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.44 -179.879 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 93' ' ' HIS . . . . . 0.507 ' CG ' ' ND1' ' B' ' 223' ' ' HIS . 42.8 m80 -43.46 -63.85 0.75 Allowed 'General case' 0 C--O 1.236 0.373 0 CA-C-O 120.978 0.418 . . . . 0.0 110.413 179.775 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 29.5 m -48.7 -35.02 6.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.189 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.586 ' HB3' ' O ' ' A' ' 92' ' ' THR . . . -64.41 -37.65 88.25 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.231 179.317 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.423 ' O ' ' OE2' ' A' ' 100' ' ' GLU . 99.1 mm-40 -63.17 -46.11 88.69 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 116.159 -0.473 . . . . 0.0 109.99 -179.894 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.804 HD21 ' HB2' ' B' ' 220' ' ' ALA . 9.0 mp -61.7 -43.52 98.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.133 -179.705 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 38.1 tp -65.47 -36.92 85.31 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.322 179.622 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' ASP . . . . . 0.548 ' CG ' HH21 ' A' ' 43' ' ' ARG . 94.7 m-20 -60.1 -45.5 92.75 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.113 -0.494 . . . . 0.0 109.895 -179.527 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.528 ' N ' ' OE1' ' A' ' 100' ' ' GLU . 0.4 OUTLIER -65.41 -53.24 45.95 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.284 -0.416 . . . . 0.0 109.997 179.586 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.751 ' HB2' HD21 ' B' ' 216' ' ' LEU . . . -53.24 -43.51 67.39 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.559 -0.456 . . . . 0.0 110.221 179.41 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 3.7 mm -60.59 -47.9 90.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 C-N-CA 120.369 -0.532 . . . . 0.0 110.516 -178.82 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -63.02 -40.12 96.81 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.391 -179.759 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' HIS . . . . . 0.443 ' ND1' ' CG ' ' B' ' 212' ' ' HIS . 81.3 t60 -60.21 -47.15 87.16 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.744 -179.65 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 11.0 t -74.34 -38.56 63.22 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.107 0.48 . . . . 0.0 111.222 179.76 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 81.9 tt0 -59.15 -39.09 81.32 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.793 -179.069 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 57.3 t-80 -53.74 -71.35 0.08 Allowed 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.215 -179.343 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.424 ' O ' ' O ' ' A' ' 109' ' ' HIS . 58.8 tp -96.48 97.22 9.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.946 0.403 . . . . 0.0 109.957 179.771 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 109' ' ' HIS . . . . . 0.424 ' O ' ' O ' ' A' ' 108' ' ' LEU . 32.2 m80 -57.66 -155.13 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.472 179.847 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 86.8 mt -61.67 -42.42 98.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.784 -179.74 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 67.5 19.57 70.96 Favored Glycine 0 CA--C 1.519 0.303 0 N-CA-C 110.828 -0.909 . . . . 0.0 110.828 179.795 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 56.2 tp -101.48 84.74 2.64 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.839 0.352 . . . . 0.0 110.432 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 27.8 m -170.19 104.09 0.29 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.545 179.613 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 55.13 44.31 28.08 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.578 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 42.6 ttm180 -65.46 137.21 57.3 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.458 -179.801 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 70.5 m-70 -154.53 151.04 22.95 Favored Pre-proline 0 N--CA 1.452 -0.325 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.66 179.742 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_exo -44.98 -39.34 14.32 Favored 'Trans proline' 0 C--N 1.311 -1.414 0 C-N-CA 122.513 2.142 . . . . 0.0 112.246 179.518 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 62.2 m -60.72 -41.49 95.42 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.51 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . 53.56 45.48 28.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.6 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.729 0 CA-C-O 118.087 -1.396 . . . . 0.0 111.005 -179.956 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.314 0 N-CA-C 109.567 -1.413 . . . . 0.0 109.567 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 122' ' ' HIS . . . . . 0.431 ' O ' ' ND1' ' B' ' 122' ' ' HIS . 52.6 t-80 45.49 37.81 3.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.848 0.356 . . . . 0.0 110.599 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 123' ' ' GLY . . . . . . . . . . . . . . . -171.02 -179.09 41.98 Favored Glycine 0 CA--C 1.522 0.502 0 N-CA-C 110.776 -0.929 . . . . 0.0 110.776 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 35.9 m -119.67 131.44 72.19 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.293 0 CA-C-O 120.864 0.364 . . . . 0.0 110.532 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 125' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -61.69 -68.03 0.36 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.611 -179.804 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 147.66 145.95 4.26 Favored Glycine 0 CA--C 1.524 0.594 0 N-CA-C 110.826 -0.91 . . . . 0.0 110.826 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 127' ' ' ARG . . . . . . . . . . . . . 84.8 mtt85 -61.96 -43.07 99.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.707 0.289 . . . . 0.0 110.683 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 128' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 54.39 55.36 8.19 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.616 179.755 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 129' ' ' ARG . . . . . . . . . . . . . 83.6 mtm180 -66.5 147.71 98.87 Favored Pre-proline 0 N--CA 1.451 -0.377 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.673 -179.34 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -68.78 147.94 70.23 Favored 'Trans proline' 0 N--CA 1.494 1.519 0 C-N-CA 122.697 2.265 . . . . 0.0 111.941 179.658 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 45.3 t -107.54 98.66 8.24 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.312 179.28 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 132' ' ' ALA . . . . . . . . . . . . . . . -172.69 150.88 2.2 Favored Pre-proline 0 N--CA 1.449 -0.486 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.897 179.577 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 133' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -67.61 146.48 73.67 Favored 'Trans proline' 0 C--N 1.31 -1.47 0 C-N-CA 122.832 2.355 . . . . 0.0 111.675 179.439 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 134' ' ' LEU . . . . . 0.877 ' H ' HD23 ' B' ' 134' ' ' LEU . 1.2 pt? -108.94 2.63 21.52 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.736 179.873 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 135' ' ' ASP . . . . . 0.481 ' N ' ' OD1' ' B' ' 135' ' ' ASP . 26.5 p-10 -33.47 -47.08 0.21 Allowed 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 120.929 0.395 . . . . 0.0 110.841 -179.232 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 136' ' ' SER . . . . . 0.445 ' N ' ' OD1' ' B' ' 135' ' ' ASP . 89.8 p -52.98 -50.59 63.84 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.293 179.098 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 137' ' ' GLN . . . . . 0.51 ' N ' ' O ' ' B' ' 134' ' ' LEU . 11.2 tp-100 -61.5 -44.22 97.47 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 109.851 -0.425 . . . . 0.0 109.851 179.786 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 138' ' ' ALA . . . . . 0.522 ' O ' HG23 ' B' ' 142' ' ' VAL . . . -58.14 -29.24 65.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.23 179.763 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -72.57 -52.45 15.48 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 121.032 0.444 . . . . 0.0 110.395 179.714 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -64.75 -40.25 94.98 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.95 179.823 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 59.0 tt0 -64.6 -53.18 51.78 Favored 'General case' 0 C--O 1.241 0.642 0 CA-C-O 121.349 0.595 . . . . 0.0 110.859 -179.6 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 142' ' ' VAL . . . . . 0.522 HG23 ' O ' ' B' ' 138' ' ' ALA . 96.8 t -62.76 -44.49 99.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.051 179.645 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -53.72 -43.97 69.46 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 179.717 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 14.8 t -57.99 -44.42 87.13 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 179.835 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 9.9 m -63.2 -45.64 90.74 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.102 178.996 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 96.2 mt -64.32 -22.56 66.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.524 179.583 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 147' ' ' GLN . . . . . 0.501 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 55.1 tt0 -75.02 -55.71 5.47 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.289 179.357 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -58.09 -55.58 33.16 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.371 -179.803 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.505 ' O ' ' O ' ' B' ' 150' ' ' ALA . 93.6 mt -45.41 -35.88 3.96 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.342 -179.557 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 150' ' ' ALA . . . . . 0.505 ' O ' ' O ' ' B' ' 149' ' ' LEU . . . -56.45 -139.76 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 O-C-N 123.56 0.537 . . . . 0.0 110.518 179.5 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 151' ' ' THR . . . . . 0.449 ' O ' ' O ' ' B' ' 150' ' ' ALA . 95.7 m 57.37 114.49 0.02 OUTLIER Pre-proline 0 C--N 1.323 -0.558 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.293 179.947 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -48.99 -47.76 20.52 Favored 'Trans proline' 0 N--CA 1.493 1.474 0 C-N-CA 122.292 1.995 . . . . 0.0 112.819 -179.042 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 67.9 m -61.91 -46.78 87.88 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.29 -179.022 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 3.2 tpp180 -62.61 -47.37 84.06 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.403 -178.919 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 155' ' ' LEU . . . . . 0.591 HD23 ' O ' ' B' ' 155' ' ' LEU . 2.7 tt -60.74 -52.96 62.88 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.43 -178.571 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 63.0 ttp -50.42 -48.06 56.33 Favored 'General case' 0 C--O 1.238 0.488 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.243 179.718 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 5.9 mm -62.71 -44.0 99.11 Favored 'Isoleucine or valine' 0 C--O 1.238 0.497 0 CA-C-O 121.019 0.437 . . . . 0.0 110.623 179.839 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 63.3 mt -61.73 -41.7 97.99 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.532 179.541 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 9.9 m -58.0 -40.05 79.8 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.71 179.572 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -63.05 -44.35 96.08 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.826 -0.35 . . . . 0.0 110.421 179.417 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 161' ' ' LEU . . . . . 0.466 ' O ' ' N ' ' B' ' 163' ' ' ASN . 76.7 mt -62.83 -31.76 72.83 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.142 179.502 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 162' ' ' ARG . . . . . 0.524 HH21 ' CG ' ' B' ' 218' ' ' ASP . 33.4 tpt85 -34.58 -33.69 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 O-C-N 123.548 0.53 . . . . 0.0 110.959 -179.612 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 163' ' ' ASN . . . . . 0.466 ' N ' ' O ' ' B' ' 161' ' ' LEU . 86.9 m-20 -70.13 -83.0 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.293 179.671 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . 147.92 -76.05 0.26 Allowed Glycine 0 CA--C 1.525 0.675 0 N-CA-C 110.933 -0.867 . . . . 0.0 110.933 179.921 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -68.36 84.41 0.47 Allowed 'Trans proline' 0 N--CA 1.496 1.62 0 C-N-CA 122.71 2.274 . . . . 0.0 112.298 -179.721 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -157.02 66.72 3.99 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.101 0.477 . . . . 0.0 110.169 -179.552 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -44.51 171.36 0.02 OUTLIER 'Trans proline' 0 C--N 1.299 -2.053 0 C-N-CA 122.452 2.101 . . . . 0.0 112.143 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . 83.0 t -54.26 -46.57 68.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.324 -179.409 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 169' ' ' THR . . . . . . . . . . . . . 12.6 m -61.6 -37.81 85.29 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.274 0.559 . . . . 0.0 110.417 179.272 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -67.01 -40.55 87.32 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.133 179.78 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 171' ' ' LEU . . . . . 0.624 ' O ' HD13 ' B' ' 171' ' ' LEU . 0.2 OUTLIER -62.73 -42.07 99.49 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.9 -179.933 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 172' ' ' ALA . . . . . 0.575 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -56.54 -48.47 77.22 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 179.406 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -54.56 -43.95 72.48 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.013 179.592 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -56.95 -55.85 29.29 Favored 'General case' 0 C--O 1.232 0.154 0 C-N-CA 120.696 -0.402 . . . . 0.0 110.687 179.698 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 89.7 mt -81.97 -68.66 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.299 179.497 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 176' ' ' GLY . . . . . 0.575 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 132.33 72.71 0.1 OUTLIER Glycine 0 CA--C 1.52 0.37 0 N-CA-C 110.962 -0.855 . . . . 0.0 110.962 179.742 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 177' ' ' MET . . . . . 0.474 ' CB ' ' O ' ' B' ' 176' ' ' GLY . 1.2 tmm? 79.86 96.47 0.06 Allowed 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 120.914 -0.314 . . . . 0.0 110.794 179.517 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -174.5 34.18 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.202 179.799 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -68.54 -23.29 64.51 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.899 -179.484 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 69.8 p -66.45 -44.88 81.6 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.055 -179.75 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -62.59 -34.99 78.11 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.382 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 97.9 t -66.98 -52.34 45.01 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.225 0 C-N-CA 120.602 -0.439 . . . . 0.0 110.509 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 50.0 m -55.21 -43.89 74.85 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.57 -0.452 . . . . 0.0 110.455 -179.684 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 184' ' ' HIS . . . . . 0.453 ' O ' HG22 ' B' ' 188' ' ' VAL . 77.7 m-70 -67.78 -42.91 80.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.034 179.756 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 69.7 mt-30 -62.74 -39.97 95.77 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.338 -179.848 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -67.93 -40.59 83.3 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 120.993 0.425 . . . . 0.0 110.592 178.871 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 16.8 tpt85 -58.65 -46.31 87.41 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.712 -178.737 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 188' ' ' VAL . . . . . 0.595 HG23 ' N ' ' B' ' 189' ' ' LEU . 29.4 m -75.85 -52.59 17.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.537 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 189' ' ' LEU . . . . . 0.595 ' N ' HG23 ' B' ' 188' ' ' VAL . 72.1 mt -53.53 -39.91 65.07 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.161 -0.472 . . . . 0.0 109.746 -179.793 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 77.3 ttt180 -67.16 -43.18 82.93 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.453 179.038 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -59.35 -51.66 68.95 Favored 'General case' 0 C--O 1.23 0.071 0 C-N-CA 120.553 -0.459 . . . . 0.0 110.395 -179.407 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 192' ' ' LEU . . . . . 0.498 ' N ' HD22 ' B' ' 192' ' ' LEU . 4.1 mm? -68.12 -39.34 82.79 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.83 178.97 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 96.05 97.89 1.81 Allowed Glycine 0 CA--C 1.522 0.522 0 N-CA-C 110.915 -0.874 . . . . 0.0 110.915 -179.58 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 194' ' ' LEU . . . . . 0.414 ' H ' ' H ' ' B' ' 195' ' ' VAL . 4.2 tp -162.19 -9.0 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.904 0.383 . . . . 0.0 110.716 179.791 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 195' ' ' VAL . . . . . 0.414 ' H ' ' H ' ' B' ' 194' ' ' LEU . 34.4 m -139.42 161.65 27.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.382 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 196' ' ' VAL . . . . . 0.422 HG23 ' CD2' ' B' ' 209' ' ' TYR . 41.1 t -139.8 154.52 24.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 121.043 0.449 . . . . 0.0 110.473 179.892 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 197' ' ' GLY . . . . . 0.402 ' N ' ' CG1' ' B' ' 196' ' ' VAL . . . -143.21 153.09 24.56 Favored Glycine 0 CA--C 1.519 0.334 0 N-CA-C 111.002 -0.839 . . . . 0.0 111.002 179.505 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 198' ' ' ASP . . . . . 0.434 ' N ' ' OD1' ' B' ' 198' ' ' ASP . 5.8 p-10 -132.65 106.66 7.93 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.83 0.348 . . . . 0.0 110.456 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 61.6 ttp180 -84.87 132.12 34.43 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.642 179.787 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 200' ' ' ALA . . . . . . . . . . . . . . . -137.38 94.49 2.94 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.213 179.413 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 201' ' ' GLY . . . . . . . . . . . . . . . 64.66 -110.95 3.79 Favored Glycine 0 CA--C 1.521 0.463 0 N-CA-C 110.879 -0.889 . . . . 0.0 110.879 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 202' ' ' ARG . . . . . . . . . . . . . 41.0 mmm-85 -107.91 15.28 24.58 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 120.683 0.278 . . . . 0.0 110.526 -179.764 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 49.1 p -136.51 114.03 10.95 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-O 121.018 0.437 . . . . 0.0 110.53 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 204' ' ' ILE . . . . . 0.476 ' CD1' ' CD2' ' B' ' 206' ' ' TYR . 0.0 OUTLIER -116.07 154.94 17.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.308 179.635 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 58.8 t -129.18 123.55 58.61 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.187 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.686 178.738 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 206' ' ' TYR . . . . . 0.476 ' CD2' ' CD1' ' B' ' 204' ' ' ILE . 5.0 m-85 -107.24 129.81 54.82 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.655 179.207 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 49.2 m -150.59 168.56 23.9 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.361 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 208' ' ' LEU . . . . . 0.403 ' H ' ' HG ' ' B' ' 208' ' ' LEU . 18.1 mt -63.21 152.12 38.45 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.376 -179.65 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 209' ' ' TYR . . . . . 0.422 ' CD2' HG23 ' B' ' 196' ' ' VAL . 6.4 t80 -55.04 -48.71 73.07 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.368 -179.343 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 84.3 m-20 -132.88 177.84 7.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.936 0.398 . . . . 0.0 110.402 -179.909 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 211' ' ' THR . . . . . 0.625 ' O ' ' HB3' ' B' ' 214' ' ' ALA . 24.3 m -92.83 -20.02 21.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.457 -179.843 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 212' ' ' HIS . . . . . 0.443 ' CG ' ' ND1' ' A' ' 104' ' ' HIS . 38.3 m80 -41.24 -65.44 0.43 Allowed 'General case' 0 C--O 1.237 0.429 0 CA-C-O 120.912 0.387 . . . . 0.0 110.557 179.876 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 22.8 m -47.88 -34.06 4.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.199 179.888 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 214' ' ' ALA . . . . . 0.625 ' HB3' ' O ' ' B' ' 211' ' ' THR . . . -65.04 -38.34 90.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.255 179.205 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 215' ' ' GLN . . . . . 0.412 ' O ' ' OE2' ' B' ' 219' ' ' GLU . 99.4 mm-40 -62.09 -46.99 86.64 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 121.056 0.455 . . . . 0.0 110.095 -179.908 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 216' ' ' LEU . . . . . 0.751 HD21 ' HB2' ' A' ' 101' ' ' ALA . 8.0 mp -61.01 -42.64 98.84 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.27 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 217' ' ' LEU . . . . . 0.402 HD12 ' HA ' ' B' ' 217' ' ' LEU . 45.7 tp -65.86 -37.34 85.93 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.383 179.523 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 218' ' ' ASP . . . . . 0.524 ' CG ' HH21 ' B' ' 162' ' ' ARG . 99.5 m-20 -59.9 -43.8 94.63 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.17 -0.468 . . . . 0.0 109.957 -179.469 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 219' ' ' GLU . . . . . 0.497 ' OE1' ' N ' ' B' ' 219' ' ' GLU . 0.6 OUTLIER -67.94 -52.12 39.74 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.15 179.344 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 220' ' ' ALA . . . . . 0.804 ' HB2' HD21 ' A' ' 97' ' ' LEU . . . -53.22 -44.22 67.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.166 179.477 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 4.9 mm -61.61 -45.9 97.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 C-N-CA 120.312 -0.555 . . . . 0.0 110.876 -179.34 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -63.36 -39.82 95.57 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.499 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 223' ' ' HIS . . . . . 0.507 ' ND1' ' CG ' ' A' ' 93' ' ' HIS . 81.5 t60 -60.85 -46.77 89.28 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.728 -179.832 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 10.5 t -73.91 -39.81 63.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.156 179.65 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -56.94 -40.19 75.92 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.653 -179.252 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 53.2 t-80 -53.51 -71.37 0.07 Allowed 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 120.568 -0.453 . . . . 0.0 110.338 -179.181 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 227' ' ' LEU . . . . . 0.418 ' O ' ' O ' ' B' ' 228' ' ' HIS . 46.9 tp -96.96 98.17 9.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.977 0.418 . . . . 0.0 110.077 179.934 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 228' ' ' HIS . . . . . 0.418 ' O ' ' O ' ' B' ' 227' ' ' LEU . 89.4 m-70 -57.68 -155.23 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.482 179.725 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 229' ' ' LEU . . . . . . . . . . . . . 85.0 mt -62.21 -42.17 99.05 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.503 -179.851 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . 67.63 20.49 72.06 Favored Glycine 0 CA--C 1.518 0.252 0 N-CA-C 110.928 -0.869 . . . . 0.0 110.928 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 231' ' ' LEU . . . . . . . . . . . . . 56.7 tp -102.18 84.43 2.49 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.742 0.306 . . . . 0.0 110.46 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 232' ' ' SER . . . . . . . . . . . . . 47.5 m -170.46 105.61 0.29 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.614 179.586 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 233' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 54.17 42.9 31.32 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.547 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 234' ' ' ARG . . . . . . . . . . . . . 43.3 ttm180 -64.39 137.11 57.72 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.347 -179.717 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 235' ' ' HIS . . . . . . . . . . . . . 74.6 m-70 -154.22 150.67 22.78 Favored Pre-proline 0 CA--C 1.533 0.299 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.693 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 236' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_exo -44.28 -40.26 12.71 Favored 'Trans proline' 0 C--N 1.31 -1.465 0 C-N-CA 122.557 2.171 . . . . 0.0 112.246 179.281 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 237' ' ' SER . . . . . . . . . . . . . 69.8 m -60.16 -40.84 91.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.505 -179.89 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 238' ' ' ALA . . . . . . . . . . . . . . . 54.84 44.21 28.77 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.578 -179.931 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.702 0 CA-C-O 117.954 -1.47 . . . . 0.0 110.952 179.902 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.366 0 N-CA-C 109.517 -1.433 . . . . 0.0 109.517 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 77.8 m80 -153.47 67.69 0.78 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.792 0.329 . . . . 0.0 110.585 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 78.71 -169.74 54.41 Favored Glycine 0 CA--C 1.523 0.59 0 N-CA-C 111.04 -0.824 . . . . 0.0 111.04 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 97.6 t -63.25 -44.4 99.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 120.88 0.372 . . . . 0.0 110.71 -179.865 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 78.8 tt0 -132.21 147.72 52.43 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.511 -179.876 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -175.53 -161.68 25.39 Favored Glycine 0 CA--C 1.522 0.519 0 N-CA-C 110.728 -0.949 . . . . 0.0 110.728 -179.853 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 17.6 ptm180 -139.53 159.98 40.9 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.893 0.377 . . . . 0.0 110.52 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 36.9 p30 -151.6 167.66 27.41 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.395 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 7.8 mmp_? -142.56 75.38 18.91 Favored Pre-proline 0 N--CA 1.464 0.241 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.338 -179.847 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -58.42 143.63 97.52 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 C-N-CA 122.549 2.166 . . . . 0.0 112.123 179.695 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 63.1 m 52.98 87.66 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.516 179.76 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -175.02 74.27 0.3 Allowed Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.522 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -53.84 134.07 57.38 Favored 'Trans proline' 0 C--N 1.307 -1.658 0 C-N-CA 122.662 2.242 . . . . 0.0 111.831 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 67.8 mt -103.15 -133.32 0.3 Allowed 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.699 179.829 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 -97.81 -57.71 2.17 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.294 0.568 . . . . 0.0 110.994 179.54 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 93.4 p -58.77 -33.67 70.57 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.279 -179.424 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 -68.59 -48.22 64.73 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.439 179.52 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.5 ' O ' HG23 ' A' ' 23' ' ' VAL . . . -55.68 -38.42 69.6 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 -179.81 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.64 -53.13 45.68 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 120.996 0.427 . . . . 0.0 110.259 179.606 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.98 -43.37 95.16 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 120.702 -0.399 . . . . 0.0 110.842 -179.859 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -64.17 -53.13 54.28 Favored 'General case' 0 C--O 1.242 0.665 0 CA-C-O 121.394 0.616 . . . . 0.0 111.045 -179.463 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.5 HG23 ' O ' ' A' ' 19' ' ' ALA . 96.0 t -61.73 -45.48 98.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.183 179.801 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.13 -41.3 83.39 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 179.853 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 45.6 t -57.08 -45.33 83.42 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 -179.724 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.428 ' OG1' ' O ' ' A' ' 23' ' ' VAL . 20.8 p -65.56 -44.68 86.02 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 120.755 -0.378 . . . . 0.0 110.497 178.97 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 96.1 mt -64.42 -23.72 67.38 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.661 179.482 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.51 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 57.0 tt0 -75.14 -57.38 3.93 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.54 179.543 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.26 -54.55 45.77 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 120.61 -0.436 . . . . 0.0 110.466 -179.417 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.489 ' O ' ' O ' ' A' ' 31' ' ' ALA . 88.7 mt -46.08 -34.62 4.27 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.27 -179.55 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.51 ' HB3' ' O ' ' A' ' 28' ' ' GLN . . . -57.03 -129.44 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 O-C-N 123.642 0.589 . . . . 0.0 110.364 179.437 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.467 ' HG1' ' HB2' ' A' ' 35' ' ' ARG . 0.3 OUTLIER 52.8 108.31 0.02 OUTLIER Pre-proline 0 CA--C 1.54 0.572 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.331 179.561 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_exo -45.8 -59.91 1.03 Allowed 'Trans proline' 0 C--N 1.309 -1.523 0 C-N-CA 122.166 1.91 . . . . 0.0 112.882 -179.217 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 50.8 m -54.86 -45.7 74.61 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.869 -178.622 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.467 ' HB2' ' HG1' ' A' ' 32' ' ' THR . 46.0 mmm-85 -61.79 -44.76 96.23 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.027 -179.582 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.594 HD23 ' O ' ' A' ' 36' ' ' LEU . 2.0 tt -63.11 -49.0 76.16 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.423 -179.342 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 28.6 ttt -52.1 -48.53 64.72 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.242 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 38.2 mm -63.63 -43.4 98.14 Favored 'Isoleucine or valine' 0 C--O 1.244 0.801 0 CA-C-O 121.189 0.519 . . . . 0.0 110.574 179.542 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 15.7 tp -61.76 -41.28 97.48 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.225 -179.55 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 19.6 m -61.27 -42.41 98.58 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 179.364 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 10.6 tp-100 -54.34 -48.06 71.84 Favored 'General case' 0 C--O 1.233 0.19 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 17.2 mt -64.29 -40.15 95.38 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.509 -0.476 . . . . 0.0 111.087 178.774 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.405 HH21 HD13 ' A' ' 98' ' ' LEU . 30.1 ttm180 -46.03 -25.51 0.58 Allowed 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.35 -179.186 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 97.8 m-20 -61.59 -39.84 92.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.582 -179.94 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 157.66 -176.89 34.67 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.911 -0.876 . . . . 0.0 110.911 179.846 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -78.35 117.9 4.17 Favored 'Trans proline' 0 C--N 1.309 -1.501 0 C-N-CA 122.885 2.39 . . . . 0.0 111.67 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.541 HD12 ' O ' ' A' ' 47' ' ' LEU . 0.3 OUTLIER -148.75 128.25 6.39 Favored Pre-proline 0 CA--C 1.543 0.693 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.368 -179.58 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -47.53 167.28 0.09 OUTLIER 'Trans proline' 0 C--N 1.307 -1.613 0 C-N-CA 122.266 1.978 . . . . 0.0 112.475 178.745 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.424 ' CG2' ' N ' ' A' ' 50' ' ' THR . 2.4 m -61.06 -37.36 77.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-O 121.586 0.708 . . . . 0.0 110.518 179.91 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.424 ' N ' ' CG2' ' A' ' 49' ' ' VAL . 26.9 m -59.99 -44.93 94.19 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 115.029 -0.987 . . . . 0.0 110.386 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 55.4 m-20 -66.21 -39.33 89.55 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.122 178.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.652 HD23 ' O ' ' A' ' 52' ' ' LEU . 4.8 tt -61.55 -42.51 98.94 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.795 -179.886 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.563 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -60.75 -43.85 97.45 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 179.719 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -55.14 -44.79 75.4 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.63 -0.428 . . . . 0.0 109.878 179.789 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -62.53 -39.67 94.33 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.731 -0.388 . . . . 0.0 110.602 179.622 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.504 HD12 ' CD2' ' A' ' 52' ' ' LEU . 90.9 mt -94.38 -78.08 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.239 179.577 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' GLY . . . . . 0.563 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 150.11 83.55 0.04 OUTLIER Glycine 0 CA--C 1.521 0.408 0 N-CA-C 111.663 -0.575 . . . . 0.0 111.663 179.622 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.407 ' O ' ' OE1' ' A' ' 59' ' ' GLU . 87.1 mtp 57.49 103.32 0.02 OUTLIER 'General case' 0 CA--C 1.518 -0.283 0 CA-C-O 121.015 0.436 . . . . 0.0 111.047 179.008 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.407 ' OE1' ' O ' ' A' ' 58' ' ' MET . 3.6 tp10 -174.86 32.74 0.01 OUTLIER 'General case' 0 N--CA 1.456 -0.132 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.298 179.78 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 -63.1 -23.85 67.63 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.057 -178.907 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 78.0 p -71.06 -43.73 67.19 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.087 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.403 ' O ' ' NE2' ' A' ' 66' ' ' GLN . . . -64.07 -29.7 70.82 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.174 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 92.4 t -74.45 -52.07 20.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 C-N-CA 120.809 -0.356 . . . . 0.0 110.615 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 67.9 p -56.03 -45.43 79.16 Favored 'General case' 0 C--O 1.233 0.192 0 C-N-CA 120.533 -0.467 . . . . 0.0 110.651 -179.77 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 34.0 m80 -66.25 -50.9 62.17 Favored 'General case' 0 C--O 1.242 0.662 0 CA-C-O 121.171 0.51 . . . . 0.0 111.235 -179.866 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.403 ' NE2' ' O ' ' A' ' 62' ' ' ALA . 28.6 mt-30 -58.34 -31.56 67.69 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.245 179.458 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.416 ' O ' ' CG ' ' A' ' 71' ' ' ARG . 5.1 tp -69.65 -43.39 72.71 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.446 179.931 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 82.3 mtp180 -60.19 -49.75 76.4 Favored 'General case' 0 C--O 1.245 0.843 0 CA-C-O 121.512 0.673 . . . . 0.0 111.167 -179.298 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.593 HG13 ' N ' ' A' ' 70' ' ' LEU . 4.4 p -66.2 -54.55 25.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.349 179.523 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.593 ' N ' HG13 ' A' ' 69' ' ' VAL . 70.8 mt -54.17 -35.23 62.07 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 -179.65 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.416 ' CG ' ' O ' ' A' ' 67' ' ' LEU . 11.9 mmm180 -61.78 -40.46 95.29 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.651 179.148 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -62.78 -42.97 99.93 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.075 -179.799 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.485 HD23 ' N ' ' A' ' 73' ' ' LEU . 6.9 mt -67.61 -42.34 82.57 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.422 -179.496 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 100.9 37.54 3.63 Favored Glycine 0 CA--C 1.522 0.483 0 N-CA-C 111.22 -0.752 . . . . 0.0 111.22 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -100.43 -15.37 17.95 Favored 'General case' 0 CA--C 1.512 -0.483 0 O-C-N 122.825 -0.221 . . . . 0.0 110.897 179.534 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 23.2 m -136.57 158.58 37.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-O 120.846 0.355 . . . . 0.0 110.049 -179.815 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.432 ' CG1' ' N ' ' A' ' 78' ' ' GLY . 40.1 t -142.48 156.53 18.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.622 179.836 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.432 ' N ' ' CG1' ' A' ' 77' ' ' VAL . . . -105.13 167.68 15.18 Favored Glycine 0 CA--C 1.522 0.524 0 N-CA-C 110.309 -1.116 . . . . 0.0 110.309 179.555 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 68.0 t0 -146.05 122.38 10.93 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.602 0.239 . . . . 0.0 110.568 -179.374 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 77.1 mtp85 -77.12 163.49 26.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.887 179.751 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.463 ' O ' ' N ' ' A' ' 83' ' ' ARG . . . -166.98 107.95 0.64 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.753 -179.905 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 53.56 -87.88 0.01 OUTLIER Glycine 0 CA--C 1.522 0.508 0 N-CA-C 110.707 -0.957 . . . . 0.0 110.707 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.463 ' N ' ' O ' ' A' ' 81' ' ' ALA . 50.7 ttt85 -136.61 42.75 2.48 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 121.064 0.459 . . . . 0.0 110.089 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 87.7 p -163.65 162.17 24.06 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.793 0.33 . . . . 0.0 110.26 179.897 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.628 HD11 ' CZ ' ' A' ' 87' ' ' TYR . 1.2 pp -134.25 155.59 39.47 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-O 120.88 0.372 . . . . 0.0 110.345 179.578 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.419 ' N ' HD12 ' A' ' 85' ' ' ILE . 18.6 t -133.23 156.74 42.3 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.262 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.403 178.959 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.628 ' CZ ' HD11 ' A' ' 85' ' ' ILE . 44.2 m-85 -106.0 136.64 45.3 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.532 -179.496 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 94.8 p -151.91 172.7 15.82 Favored 'General case' 0 C--O 1.224 -0.289 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.423 -179.798 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 56.3 mt -65.41 148.2 52.12 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.656 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.413 ' CD2' HG23 ' A' ' 77' ' ' VAL . 10.2 t80 -52.71 -48.5 66.59 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.312 -179.456 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.486 ' OD2' ' CD2' ' B' ' 227' ' ' LEU . 46.5 p-10 -146.77 -179.78 7.03 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.781 0.324 . . . . 0.0 110.555 -179.857 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' THR . . . . . 0.453 ' O ' ' HB3' ' A' ' 95' ' ' ALA . 42.0 p -88.7 -16.34 32.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.558 -179.844 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 58.4 m80 -46.88 -65.38 0.57 Allowed 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.048 0.452 . . . . 0.0 110.697 -179.872 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 11.9 p -52.79 -35.25 21.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.193 -179.779 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.453 ' HB3' ' O ' ' A' ' 92' ' ' THR . . . -62.97 -40.35 97.44 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.411 179.493 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -63.55 -44.45 94.12 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 116.013 -0.54 . . . . 0.0 109.895 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 13.9 tp -60.02 -42.71 94.94 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.158 -179.835 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.405 HD13 HH21 ' A' ' 43' ' ' ARG . 87.5 mt -63.39 -39.2 93.87 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.154 179.801 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -60.28 -42.86 96.33 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.103 -179.831 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 73.8 mm-40 -67.72 -47.69 68.64 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.542 179.617 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.14 -44.29 92.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.262 -0.426 . . . . 0.0 109.949 179.684 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 5.0 mm -62.94 -44.13 99.43 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.639 -179.561 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -60.08 -42.19 94.07 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.998 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 35.0 m170 -68.77 -35.96 77.72 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.245 179.788 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 7.0 t -59.02 -47.98 83.25 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.322 -179.692 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -74.8 -57.28 4.01 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.003 0.43 . . . . 0.0 110.431 179.465 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 53.3 m170 -52.32 -37.65 56.43 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.043 -179.867 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.501 ' CD2' ' OD2' ' B' ' 210' ' ' ASP . 39.1 tp -135.53 104.44 5.82 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.398 179.36 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 109' ' ' HIS . . . . . 0.446 ' O ' ' CG ' ' A' ' 109' ' ' HIS . 49.0 p-80 -116.19 105.46 12.6 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.866 179.636 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.558 ' N ' HD12 ' A' ' 110' ' ' LEU . 9.8 mp -64.13 -42.05 96.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.306 179.768 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 82.95 58.41 2.35 Favored Glycine 0 CA--C 1.521 0.444 0 N-CA-C 110.935 -0.866 . . . . 0.0 110.935 -179.743 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 55.8 tp -96.94 135.02 39.52 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.902 0.382 . . . . 0.0 110.531 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 47.3 t -63.54 145.25 56.04 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.648 179.651 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -81.29 -3.62 53.07 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.604 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 53.7 ptt85 -139.36 156.02 47.28 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.575 -179.806 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 116' ' ' HIS . . . . . 0.54 ' N ' ' HD2' ' A' ' 117' ' ' PRO . 0.4 OUTLIER 178.7 -58.91 0.0 OUTLIER Pre-proline 0 C--N 1.321 -0.644 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.943 -179.354 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 117' ' ' PRO . . . . . 0.54 ' HD2' ' N ' ' A' ' 116' ' ' HIS . 24.3 Cg_endo -60.64 -25.5 81.0 Favored 'Trans proline' 0 N--CA 1.491 1.339 0 C-N-CA 122.57 2.18 . . . . 0.0 111.738 -179.184 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 34.4 t -64.99 140.73 58.9 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.598 -179.673 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -162.4 -36.38 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.618 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.219 -0.789 0 CA-C-O 118.035 -1.425 . . . . 0.0 110.945 -179.958 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.354 0 N-CA-C 109.494 -1.442 . . . . 0.0 109.494 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 79.0 m80 -149.37 67.92 1.03 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.811 0.338 . . . . 0.0 110.522 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 123' ' ' GLY . . . . . . . . . . . . . . . 79.21 -169.42 53.88 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 111.006 -0.837 . . . . 0.0 111.006 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 90.5 t -63.32 -44.41 99.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 120.872 0.367 . . . . 0.0 110.768 179.918 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 125' ' ' GLU . . . . . . . . . . . . . 85.0 tt0 -133.15 147.21 52.08 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.556 -179.858 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -174.91 -161.05 23.98 Favored Glycine 0 CA--C 1.522 0.528 0 N-CA-C 110.792 -0.923 . . . . 0.0 110.792 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 127' ' ' ARG . . . . . . . . . . . . . 17.6 ptm180 -139.21 159.74 41.43 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.826 0.346 . . . . 0.0 110.482 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 128' ' ' ASN . . . . . . . . . . . . . 40.3 p30 -150.14 167.84 25.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.54 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 129' ' ' ARG . . . . . . . . . . . . . 7.8 mmp_? -144.05 74.74 15.99 Favored Pre-proline 0 C--N 1.331 -0.213 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.386 -179.801 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo -58.6 144.72 97.17 Favored 'Trans proline' 0 C--N 1.305 -1.743 0 C-N-CA 122.517 2.145 . . . . 0.0 112.146 179.617 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 50.3 m 55.86 83.78 0.09 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.465 179.83 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 132' ' ' ALA . . . . . . . . . . . . . . . -172.5 74.27 0.44 Allowed Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.246 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 133' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_exo -54.47 135.37 65.83 Favored 'Trans proline' 0 C--N 1.307 -1.642 0 C-N-CA 122.686 2.257 . . . . 0.0 111.977 -179.59 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 134' ' ' LEU . . . . . 0.53 ' O ' ' N ' ' B' ' 137' ' ' GLN . 58.7 mt -113.95 154.45 27.56 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.017 179.546 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 135' ' ' ASP . . . . . 0.438 ' C ' ' O ' ' B' ' 134' ' ' LEU . 98.0 m-20 -32.55 -48.78 0.2 Allowed 'General case' 0 N--CA 1.466 0.37 0 O-C-N 123.544 0.528 . . . . 0.0 110.591 -179.091 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 11.2 t -59.14 -48.79 80.32 Favored 'General case' 0 C--O 1.24 0.585 0 CA-C-O 121.189 0.519 . . . . 0.0 110.711 178.933 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 137' ' ' GLN . . . . . 0.53 ' N ' ' O ' ' B' ' 134' ' ' LEU . 73.8 mt-30 -64.53 -42.78 95.55 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.948 -179.881 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 138' ' ' ALA . . . . . 0.492 ' O ' HG23 ' B' ' 142' ' ' VAL . . . -55.83 -38.86 70.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.08 -179.891 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -65.36 -53.25 46.25 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 120.933 0.396 . . . . 0.0 110.242 179.552 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -60.52 -41.85 95.22 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.532 -0.467 . . . . 0.0 110.879 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 59.5 tt0 -64.35 -53.71 44.43 Favored 'General case' 0 C--O 1.244 0.773 0 CA-C-O 121.415 0.626 . . . . 0.0 111.025 -179.573 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 142' ' ' VAL . . . . . 0.492 HG23 ' O ' ' B' ' 138' ' ' ALA . 89.4 t -62.17 -45.68 98.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.006 179.684 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -57.27 -42.09 80.97 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 44.2 t -56.58 -45.84 81.11 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 -179.725 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 145' ' ' THR . . . . . 0.458 ' OG1' ' O ' ' B' ' 142' ' ' VAL . 21.7 p -65.16 -44.02 89.89 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 120.65 -0.42 . . . . 0.0 110.54 179.078 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 95.9 mt -64.37 -24.05 67.5 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.598 179.455 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 147' ' ' GLN . . . . . 0.506 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 55.9 tt0 -75.38 -57.05 4.13 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.536 179.607 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -57.95 -54.67 44.32 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.599 -179.32 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.501 ' O ' ' O ' ' B' ' 150' ' ' ALA . 92.9 mt -46.29 -35.56 5.43 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.319 -179.66 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 150' ' ' ALA . . . . . 0.506 ' HB3' ' O ' ' B' ' 147' ' ' GLN . . . -56.69 -131.43 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.262 0.553 . . . . 0.0 110.407 179.6 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 151' ' ' THR . . . . . 0.532 ' HG1' ' HB2' ' B' ' 154' ' ' ARG . 0.4 OUTLIER 54.61 108.61 0.02 OUTLIER Pre-proline 0 CA--C 1.539 0.539 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.322 179.503 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -45.58 -61.45 0.59 Allowed 'Trans proline' 0 C--N 1.31 -1.494 0 C-N-CA 122.304 2.003 . . . . 0.0 112.868 -179.11 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 49.6 m -53.96 -46.7 71.69 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.0 -178.591 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 154' ' ' ARG . . . . . 0.532 ' HB2' ' HG1' ' B' ' 151' ' ' THR . 46.0 mmm-85 -60.46 -44.09 96.23 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 120.716 -0.394 . . . . 0.0 111.011 -179.502 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 155' ' ' LEU . . . . . 0.59 HD23 ' O ' ' B' ' 155' ' ' LEU . 1.9 tt -64.18 -49.16 73.14 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.31 -179.389 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 28.6 ttt -51.61 -49.05 62.93 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.241 -179.459 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 42.8 mm -64.24 -43.69 97.3 Favored 'Isoleucine or valine' 0 C--O 1.247 0.931 0 CA-C-O 121.188 0.518 . . . . 0.0 110.437 179.737 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 17.6 tp -60.84 -42.1 97.11 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.262 -179.516 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 19.0 m -61.57 -41.59 97.62 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.858 179.383 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 10.4 tp-100 -53.45 -49.29 67.7 Favored 'General case' 0 C--O 1.233 0.202 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 161' ' ' LEU . . . . . 0.464 ' O ' ' N ' ' B' ' 163' ' ' ASN . 8.9 mt -64.29 -40.65 96.39 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.288 -0.565 . . . . 0.0 111.153 179.054 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 162' ' ' ARG . . . . . 0.462 HH21 HD13 ' B' ' 217' ' ' LEU . 32.6 ttm180 -42.14 -23.56 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.287 -179.213 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 163' ' ' ASN . . . . . 0.464 ' N ' ' O ' ' B' ' 161' ' ' LEU . 91.4 m-20 -63.06 -41.46 99.46 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.624 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 164' ' ' GLY . . . . . 0.401 ' N ' ' O ' ' B' ' 161' ' ' LEU . . . 155.83 -170.36 33.65 Favored Glycine 0 CA--C 1.522 0.484 0 N-CA-C 111.09 -0.804 . . . . 0.0 111.09 179.523 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -74.24 120.27 6.2 Favored 'Trans proline' 0 N--CA 1.495 1.594 0 C-N-CA 122.916 2.411 . . . . 0.0 111.849 179.848 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 166' ' ' LEU . . . . . 0.5 ' O ' HD12 ' B' ' 166' ' ' LEU . 0.2 OUTLIER -151.92 120.91 3.39 Favored Pre-proline 0 CA--C 1.545 0.768 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.633 179.843 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -47.6 168.67 0.07 OUTLIER 'Trans proline' 0 C--N 1.304 -1.788 0 C-N-CA 122.26 1.974 . . . . 0.0 112.317 178.633 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 168' ' ' VAL . . . . . 0.438 HG13 ' H ' ' B' ' 168' ' ' VAL . 2.6 m -60.46 -37.75 75.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-O 121.698 0.761 . . . . 0.0 110.41 179.875 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 169' ' ' THR . . . . . 0.42 ' N ' ' CG2' ' B' ' 168' ' ' VAL . 14.0 m -60.7 -45.65 93.37 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 115.058 -0.973 . . . . 0.0 110.192 -179.944 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 71.5 m-20 -65.11 -41.15 95.17 Favored 'General case' 0 C--O 1.241 0.639 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.077 179.314 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 171' ' ' LEU . . . . . 0.59 HD23 ' O ' ' B' ' 171' ' ' LEU . 4.5 tt -61.32 -41.71 97.46 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.936 -179.541 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 172' ' ' ALA . . . . . 0.549 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -60.77 -44.03 97.28 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 179.649 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -55.26 -44.52 75.66 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.275 -0.42 . . . . 0.0 109.897 179.773 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -61.92 -41.04 97.47 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.47 179.623 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 175' ' ' ILE . . . . . 0.482 HD12 ' CD2' ' B' ' 171' ' ' LEU . 96.7 mt -93.52 -79.04 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.183 179.486 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 176' ' ' GLY . . . . . 0.549 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 151.84 82.43 0.04 OUTLIER Glycine 0 CA--C 1.52 0.388 0 N-CA-C 111.518 -0.633 . . . . 0.0 111.518 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 177' ' ' MET . . . . . 0.435 ' O ' ' OE1' ' B' ' 178' ' ' GLU . 89.0 mtp 58.34 105.37 0.02 OUTLIER 'General case' 0 CA--C 1.518 -0.253 0 CA-C-O 120.853 0.359 . . . . 0.0 110.995 179.076 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 178' ' ' GLU . . . . . 0.435 ' OE1' ' O ' ' B' ' 177' ' ' MET . 4.0 tp10 -176.87 32.75 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.28 179.75 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 7.5 mt-30 -62.84 -23.8 67.46 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.031 -179.005 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 78.7 p -70.95 -42.45 69.79 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.968 -179.697 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -65.71 -28.91 69.4 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.299 -179.898 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 97.9 t -74.8 -52.47 19.14 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.126 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.547 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 79.4 p -56.32 -43.8 79.34 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 120.541 -0.464 . . . . 0.0 110.366 -179.699 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 64.5 m-70 -66.84 -50.93 60.99 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-O 121.163 0.506 . . . . 0.0 111.078 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -58.8 -31.48 68.46 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.214 179.507 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 186' ' ' LEU . . . . . 0.415 ' O ' ' CG ' ' B' ' 190' ' ' ARG . 5.1 tp -69.77 -43.46 72.15 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.549 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 81.3 mtp180 -60.02 -49.17 78.71 Favored 'General case' 0 C--O 1.246 0.876 0 CA-C-O 121.293 0.568 . . . . 0.0 111.144 -179.376 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 188' ' ' VAL . . . . . 0.588 HG13 ' N ' ' B' ' 189' ' ' LEU . 4.9 p -67.05 -54.39 24.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.243 179.726 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 189' ' ' LEU . . . . . 0.588 ' N ' HG13 ' B' ' 188' ' ' VAL . 73.4 mt -54.21 -35.63 62.6 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 -179.657 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 190' ' ' ARG . . . . . 0.415 ' CG ' ' O ' ' B' ' 186' ' ' LEU . 12.6 mmm180 -61.36 -40.56 94.76 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.63 179.12 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -62.92 -42.58 99.85 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 120.37 -0.532 . . . . 0.0 109.969 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 192' ' ' LEU . . . . . 0.494 HD23 ' N ' ' B' ' 192' ' ' LEU . 7.2 mt -67.91 -38.29 82.78 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.42 -179.542 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 95.9 35.28 5.64 Favored Glycine 0 CA--C 1.521 0.427 0 N-CA-C 111.23 -0.748 . . . . 0.0 111.23 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -98.4 -15.89 19.5 Favored 'General case' 0 CA--C 1.512 -0.511 0 O-C-N 122.916 -0.167 . . . . 0.0 111.079 179.558 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 26.5 m -136.4 158.44 37.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.11 -179.832 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 196' ' ' VAL . . . . . 0.44 ' CG1' ' N ' ' B' ' 197' ' ' GLY . 41.2 t -142.77 156.76 18.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.595 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 197' ' ' GLY . . . . . 0.44 ' N ' ' CG1' ' B' ' 196' ' ' VAL . . . -106.08 168.69 15.13 Favored Glycine 0 CA--C 1.523 0.572 0 N-CA-C 110.418 -1.073 . . . . 0.0 110.418 179.6 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 67.9 t0 -146.38 122.76 10.98 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.769 0.319 . . . . 0.0 110.559 -179.654 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 77.7 mtp85 -76.86 163.07 27.11 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.842 179.618 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 200' ' ' ALA . . . . . 0.43 ' O ' ' N ' ' B' ' 202' ' ' ARG . . . -167.15 108.87 0.65 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.588 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 201' ' ' GLY . . . . . . . . . . . . . . . 53.75 -89.54 0.01 OUTLIER Glycine 0 CA--C 1.522 0.528 0 N-CA-C 110.709 -0.956 . . . . 0.0 110.709 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 202' ' ' ARG . . . . . 0.43 ' N ' ' O ' ' B' ' 200' ' ' ALA . 52.4 ttt85 -135.56 42.08 2.7 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 121.149 0.5 . . . . 0.0 110.07 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 84.5 p -162.78 162.97 26.88 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.872 0.368 . . . . 0.0 110.138 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 204' ' ' ILE . . . . . 0.638 HD11 ' CZ ' ' B' ' 206' ' ' TYR . 1.2 pp -133.83 156.71 41.53 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.423 179.701 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 205' ' ' VAL . . . . . 0.448 HG12 ' N ' ' B' ' 206' ' ' TYR . 21.4 t -132.93 158.43 43.27 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.391 178.974 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 206' ' ' TYR . . . . . 0.638 ' CZ ' HD11 ' B' ' 204' ' ' ILE . 45.0 m-85 -108.77 135.5 49.89 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.332 -179.668 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 83.5 p -151.56 172.06 16.62 Favored 'General case' 0 C--O 1.224 -0.289 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.429 -179.759 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . 55.3 mt -65.63 149.12 50.61 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.529 -179.764 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 209' ' ' TYR . . . . . 0.418 ' CD2' HG23 ' B' ' 196' ' ' VAL . 11.7 t80 -52.44 -48.72 65.61 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.326 -179.631 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 210' ' ' ASP . . . . . 0.501 ' OD2' ' CD2' ' A' ' 108' ' ' LEU . 42.5 p-10 -146.74 -178.94 6.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.77 0.319 . . . . 0.0 110.559 179.982 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 211' ' ' THR . . . . . 0.476 ' O ' ' HB3' ' B' ' 214' ' ' ALA . 30.7 p -88.97 -17.04 30.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.374 -179.755 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 212' ' ' HIS . . . . . . . . . . . . . 46.3 m80 -45.12 -65.21 0.56 Allowed 'General case' 0 C--O 1.237 0.419 0 CA-C-O 121.045 0.45 . . . . 0.0 110.701 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 10.7 p -53.05 -35.64 23.05 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.178 -179.823 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 214' ' ' ALA . . . . . 0.476 ' HB3' ' O ' ' B' ' 211' ' ' THR . . . -62.09 -41.96 98.73 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.392 179.55 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -62.51 -45.12 94.43 Favored 'General case' 0 C--O 1.238 0.459 0 CA-C-N 116.172 -0.467 . . . . 0.0 109.894 -179.917 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 216' ' ' LEU . . . . . . . . . . . . . 18.4 tp -60.01 -42.38 94.16 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.06 -179.648 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 217' ' ' LEU . . . . . 0.462 HD13 HH21 ' B' ' 162' ' ' ARG . 79.1 mt -63.72 -39.76 95.1 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.306 179.745 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 97.0 m-20 -59.66 -42.91 93.89 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.176 -179.806 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 219' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -67.16 -49.11 65.89 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.779 -0.368 . . . . 0.0 110.634 179.446 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -57.69 -44.99 86.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.285 -0.416 . . . . 0.0 109.924 179.689 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 4.8 mm -62.34 -43.98 98.7 Favored 'Isoleucine or valine' 0 C--O 1.237 0.442 0 CA-C-O 121.148 0.499 . . . . 0.0 110.612 -179.457 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -60.68 -42.22 96.66 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.937 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 223' ' ' HIS . . . . . . . . . . . . . 46.7 m170 -68.88 -36.3 77.91 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.113 179.838 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 43.0 t -58.73 -47.71 83.65 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.262 -179.673 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -74.9 -57.22 4.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.993 0.425 . . . . 0.0 110.586 179.236 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 59.2 m170 -52.53 -36.98 56.65 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.125 -179.809 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 227' ' ' LEU . . . . . 0.486 ' CD2' ' OD2' ' A' ' 91' ' ' ASP . 44.6 tp -136.36 104.25 5.55 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.499 179.371 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 228' ' ' HIS . . . . . 0.432 ' O ' ' CG ' ' B' ' 228' ' ' HIS . 48.0 p-80 -116.05 106.6 13.94 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 121.019 0.438 . . . . 0.0 110.766 179.46 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 229' ' ' LEU . . . . . 0.536 ' N ' HD12 ' B' ' 229' ' ' LEU . 10.4 mp -63.94 -41.23 97.67 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.415 179.747 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . 82.62 57.96 2.49 Favored Glycine 0 CA--C 1.521 0.415 0 N-CA-C 110.855 -0.898 . . . . 0.0 110.855 -179.624 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 231' ' ' LEU . . . . . . . . . . . . . 57.5 tp -97.37 137.77 35.84 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.785 0.326 . . . . 0.0 110.59 -179.865 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 232' ' ' SER . . . . . . . . . . . . . 41.1 t -66.82 146.08 54.8 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.559 179.46 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 233' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -81.65 -6.17 58.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.779 179.99 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 234' ' ' ARG . . . . . . . . . . . . . 53.5 ptt85 -136.36 156.9 47.97 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.966 0.413 . . . . 0.0 110.478 -179.881 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 235' ' ' HIS . . . . . 0.539 ' N ' ' HD2' ' B' ' 236' ' ' PRO . 0.4 OUTLIER 177.59 -58.63 0.0 OUTLIER Pre-proline 0 C--N 1.322 -0.621 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.862 -179.377 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 236' ' ' PRO . . . . . 0.539 ' HD2' ' N ' ' B' ' 235' ' ' HIS . 22.9 Cg_endo -60.45 -26.71 83.37 Favored 'Trans proline' 0 N--CA 1.492 1.439 0 C-N-CA 122.448 2.099 . . . . 0.0 111.664 -179.076 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 237' ' ' SER . . . . . . . . . . . . . 48.4 t -63.7 142.46 58.39 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.427 -179.52 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 238' ' ' ALA . . . . . . . . . . . . . . . -163.87 -33.22 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.598 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.778 0 CA-C-O 117.992 -1.449 . . . . 0.0 110.902 -179.928 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.258 0 N-CA-C 109.505 -1.438 . . . . 0.0 109.505 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 74.4 m80 -60.84 -41.42 95.8 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.84 0.352 . . . . 0.0 110.473 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLY . . . . . 0.426 ' O ' ' O ' ' A' ' 5' ' ' VAL . . . 74.49 -169.72 54.04 Favored Glycine 0 CA--C 1.524 0.652 0 N-CA-C 110.946 -0.862 . . . . 0.0 110.946 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.426 ' O ' ' O ' ' A' ' 4' ' ' GLY . 5.6 t 56.82 113.19 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 120.86 0.362 . . . . 0.0 110.527 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -122.34 124.85 44.66 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.536 179.881 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 51.32 80.28 0.07 OUTLIER Glycine 0 CA--C 1.523 0.587 0 N-CA-C 110.931 -0.868 . . . . 0.0 110.931 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 63.1 ttm-85 -61.17 -44.32 97.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.814 0.34 . . . . 0.0 110.548 -179.839 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.424 ' O ' ' OD1' ' A' ' 9' ' ' ASN . 45.0 p-10 -155.22 125.02 6.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.591 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.499 ' N ' ' CD ' ' A' ' 11' ' ' PRO . 24.6 ttm180 -168.35 50.6 0.19 Allowed Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.547 179.692 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.499 ' CD ' ' N ' ' A' ' 10' ' ' ARG . 36.5 Cg_endo -64.7 143.95 82.43 Favored 'Trans proline' 0 C--N 1.307 -1.637 0 C-N-CA 122.828 2.352 . . . . 0.0 111.924 179.849 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 20.8 p -83.1 139.61 33.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.358 179.602 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -178.74 149.4 0.62 Allowed Pre-proline 0 N--CA 1.449 -0.499 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.727 179.507 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -69.04 106.87 1.6 Allowed 'Trans proline' 0 N--CA 1.495 1.613 0 C-N-CA 122.476 2.117 . . . . 0.0 111.95 179.361 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 23.5 mt -92.36 122.16 34.55 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.151 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 95.0 m-20 -95.78 -53.02 3.85 Favored 'General case' 0 C--O 1.239 0.55 0 CA-C-O 121.258 0.552 . . . . 0.0 110.802 179.677 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 37.7 t -57.55 -42.75 83.57 Favored 'General case' 0 C--O 1.239 0.547 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.124 -179.552 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 68.4 mm-40 -66.49 -42.66 87.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.28 179.521 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.527 ' O ' HG23 ' A' ' 23' ' ' VAL . . . -51.74 -48.11 63.77 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 -179.209 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.34 -53.98 49.69 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 120.387 -0.525 . . . . 0.0 110.308 179.07 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -52.6 -48.24 66.41 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.03 179.803 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 85.8 mm-40 -56.32 -50.03 72.61 Favored 'General case' 0 C--O 1.241 0.614 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.688 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.527 HG23 ' O ' ' A' ' 19' ' ' ALA . 84.2 t -60.12 -37.66 73.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.813 179.686 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.682 ' HB2' HD12 ' B' ' 155' ' ' LEU . . . -64.86 -42.07 95.16 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.411 178.945 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 67.1 m -56.9 -49.69 74.8 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.935 0.398 . . . . 0.0 110.99 -178.693 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.414 HG23 ' N ' ' A' ' 27' ' ' LEU . 1.4 t -65.65 -48.68 71.32 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.725 179.832 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.414 ' N ' HG23 ' A' ' 26' ' ' THR . 69.1 mt -62.01 -26.06 68.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.946 179.758 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.667 ' NE2' ' NE2' ' B' ' 147' ' ' GLN . 29.6 tp60 -72.88 -60.12 2.38 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.352 179.224 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -55.64 -53.97 49.9 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.714 -179.189 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.511 ' O ' ' O ' ' A' ' 31' ' ' ALA . 7.3 mp -46.56 -35.45 5.83 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.397 -179.192 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.511 ' O ' ' O ' ' A' ' 30' ' ' LEU . . . -57.47 -132.69 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.45 0 O-C-N 123.52 0.512 . . . . 0.0 110.022 179.468 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.47 ' O ' ' O ' ' A' ' 31' ' ' ALA . 0.8 OUTLIER 54.43 113.04 0.01 OUTLIER Pre-proline 0 CA--C 1.542 0.661 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.39 179.495 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -50.45 -57.58 2.2 Favored 'Trans proline' 0 N--CA 1.495 1.609 0 C-N-CA 122.283 1.989 . . . . 0.0 113.282 -179.541 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 80.5 p -52.8 -46.09 67.52 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.22 -178.175 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 10.7 mpt_? -61.97 -42.67 99.4 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.637 -179.61 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.697 HD12 ' HB2' ' B' ' 143' ' ' ALA . 5.1 mt -61.37 -51.92 66.8 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 120.35 -0.54 . . . . 0.0 110.841 -179.159 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 11.2 tpt -53.83 -49.35 68.59 Favored 'General case' 0 C--O 1.24 0.574 0 C-N-CA 120.279 -0.568 . . . . 0.0 110.224 -179.62 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 96.7 mt -62.88 -45.58 98.5 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 CA-C-O 121.568 0.699 . . . . 0.0 110.405 -179.596 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 53.5 mt -62.21 -38.12 87.94 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.721 179.504 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 18.0 m -59.41 -41.8 90.3 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.996 179.926 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.706 ' OE1' HD11 ' A' ' 52' ' ' LEU . 2.7 pt20 -57.99 -43.82 86.8 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.282 -0.567 . . . . 0.0 110.269 179.839 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.587 ' N ' ' HG2' ' A' ' 41' ' ' GLN . 15.0 mt -64.19 -38.17 90.1 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.323 -179.411 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 73.6 ttp85 -51.0 -39.22 55.18 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.477 -179.402 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 51.4 t-20 -56.25 -39.55 72.77 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.411 -179.313 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 153.06 175.02 24.05 Favored Glycine 0 CA--C 1.524 0.595 0 N-CA-C 111.016 -0.834 . . . . 0.0 111.016 179.73 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -70.25 142.04 44.76 Favored 'Trans proline' 0 C--N 1.308 -1.6 0 C-N-CA 122.694 2.263 . . . . 0.0 111.764 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.519 HD12 ' O ' ' A' ' 47' ' ' LEU . 0.3 OUTLIER -162.81 160.62 19.44 Favored Pre-proline 0 C--N 1.326 -0.441 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.684 -179.838 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -63.26 142.01 84.47 Favored 'Trans proline' 0 N--CA 1.495 1.565 0 C-N-CA 122.519 2.146 . . . . 0.0 112.341 179.086 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 46.6 t -62.28 -43.16 97.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.423 179.457 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 89.6 m -55.86 -69.28 0.15 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.825 -179.317 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 63.1 t0 -52.23 -40.67 61.93 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.226 0.536 . . . . 0.0 109.719 -179.33 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.727 HD13 ' C ' ' A' ' 52' ' ' LEU . 2.9 tm? -59.02 -48.22 82.38 Favored 'General case' 0 C--N 1.316 -0.875 0 C-N-CA 119.732 -0.787 . . . . 0.0 110.336 -179.451 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.578 ' O ' ' N ' ' A' ' 58' ' ' MET . . . -56.34 -39.23 72.49 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.358 0.599 . . . . 0.0 110.315 -179.333 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -65.04 -28.8 69.73 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.592 179.476 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 0.401 ' HB3' ' O ' ' A' ' 52' ' ' LEU . . . -63.28 -43.42 97.98 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.923 179.928 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.43 HG23 ' N ' ' A' ' 57' ' ' GLY . 8.5 tt -164.14 -36.06 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.921 -179.556 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' GLY . . . . . 0.43 ' N ' HG23 ' A' ' 56' ' ' ILE . . . -54.74 -71.47 0.71 Allowed Glycine 0 CA--C 1.522 0.515 0 N-CA-C 111.205 -0.758 . . . . 0.0 111.205 -178.197 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.578 ' N ' ' O ' ' A' ' 53' ' ' ALA . 0.1 OUTLIER 64.64 27.21 13.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.678 0.275 . . . . 0.0 110.345 179.749 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -153.76 59.07 0.74 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.908 0.385 . . . . 0.0 110.034 -179.323 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 11.0 mt-30 -44.3 -26.05 0.29 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.525 -179.629 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 49.5 m -70.39 -46.12 64.65 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.896 179.798 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.76 -32.25 73.85 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.327 179.867 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 57.7 t -70.38 -50.63 44.64 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.273 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.689 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 11.2 t -58.08 -43.27 86.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.341 -179.664 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -62.12 -50.87 70.18 Favored 'General case' 0 C--O 1.239 0.501 0 CA-C-O 121.048 0.451 . . . . 0.0 110.79 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 86.6 mt-30 -63.36 -35.42 80.34 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.312 179.72 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 6.7 tp -62.99 -44.67 95.41 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.301 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -61.77 -40.7 96.11 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.796 0.331 . . . . 0.0 110.293 179.878 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 89.3 t -65.73 -54.28 29.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 C-N-CA 120.159 -0.616 . . . . 0.0 110.594 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 91.1 mt -60.9 -39.21 88.44 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.879 0.371 . . . . 0.0 110.059 -179.591 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 77.3 ttt-85 -59.63 -40.91 89.17 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.399 179.744 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -56.89 -47.53 80.27 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.338 -179.253 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.519 HD22 ' N ' ' A' ' 73' ' ' LEU . 4.0 mm? -65.89 -41.28 91.74 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.685 179.321 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 110.19 33.54 2.53 Favored Glycine 0 CA--C 1.526 0.749 0 N-CA-C 110.978 -0.849 . . . . 0.0 110.978 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.504 HD22 ' N ' ' A' ' 75' ' ' LEU . 3.8 mm? -91.2 -18.37 24.54 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.781 0.324 . . . . 0.0 110.601 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 31.6 m -136.38 160.13 38.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.159 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 46.5 t -134.54 142.07 41.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.421 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -115.57 140.7 16.42 Favored Glycine 0 CA--C 1.525 0.66 0 N-CA-C 110.496 -1.042 . . . . 0.0 110.496 179.299 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -118.32 105.21 11.5 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 120.837 0.351 . . . . 0.0 110.385 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 59.4 ttt85 -75.54 123.77 26.04 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.356 179.796 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -131.29 144.94 51.65 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.232 179.763 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -43.91 -35.83 3.49 Favored Glycine 0 CA--C 1.524 0.603 0 N-CA-C 110.778 -0.929 . . . . 0.0 110.778 -179.661 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 61.5 ttm-85 -70.71 -45.47 64.88 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.848 -0.341 . . . . 0.0 110.494 179.729 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 3.5 m 177.81 176.35 0.43 Allowed 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 121.017 0.437 . . . . 0.0 110.03 -179.564 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 2.1 tp -97.63 131.16 45.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.036 -0.529 . . . . 0.0 109.698 178.926 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 54.5 t -111.73 134.34 54.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.222 179.126 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 65.4 m-85 -110.72 133.22 53.53 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.325 179.787 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 26.0 t -151.14 172.13 16.27 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.143 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 60.3 mt -69.61 147.67 50.38 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.629 -179.728 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 6.9 t80 -54.54 -47.66 72.91 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.36 -179.668 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 45.6 t0 -147.03 165.29 30.34 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.869 0.366 . . . . 0.0 110.601 -179.869 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' THR . . . . . 0.556 ' O ' ' HB3' ' A' ' 95' ' ' ALA . 80.8 p -75.1 -22.32 58.33 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.578 -179.931 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 25.6 m170 -40.22 -66.13 0.34 Allowed 'General case' 0 C--O 1.236 0.368 0 CA-C-O 121.101 0.477 . . . . 0.0 110.637 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 22.7 m -50.48 -35.35 12.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.101 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.556 ' HB3' ' O ' ' A' ' 92' ' ' THR . . . -64.55 -41.06 96.56 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.542 179.607 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 96.5 mm-40 -61.27 -45.79 93.05 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.925 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 15.2 tp -60.09 -43.53 95.45 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.302 -0.559 . . . . 0.0 110.102 -179.632 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 52.3 tp -64.21 -38.06 89.7 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.077 -179.77 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.9 m-20 -60.99 -43.5 98.74 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.233 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -67.02 -43.83 81.81 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.352 179.334 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.07 -44.04 91.81 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.183 -0.462 . . . . 0.0 109.78 179.216 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 4.8 mm -63.85 -43.71 97.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 121.213 0.53 . . . . 0.0 110.588 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -60.73 -44.4 96.71 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.082 -179.886 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' HIS . . . . . 0.623 ' ND1' ' N ' ' A' ' 105' ' ' SER . 0.0 OUTLIER -67.72 -34.65 77.28 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.103 179.523 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.623 ' N ' ' ND1' ' A' ' 104' ' ' HIS . 5.6 t -59.15 -50.59 73.46 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.383 -178.141 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 13.2 tm-20 -75.35 -52.89 9.72 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.93 179.265 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 4.2 m-70 -48.71 -28.58 3.68 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.123 -178.733 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 66.9 mt -111.58 -67.3 1.01 Allowed 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.542 179.286 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' HIS . . . . . 0.523 ' N ' ' O ' ' A' ' 105' ' ' SER . 49.5 t-80 55.32 70.34 0.64 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.491 -179.801 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 96.1 mt -63.03 -41.62 99.58 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.392 -179.802 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' GLY . . . . . 0.441 ' O ' ' O ' ' A' ' 112' ' ' LEU . . . 80.42 -160.7 44.11 Favored Glycine 0 CA--C 1.524 0.621 0 N-CA-C 110.868 -0.893 . . . . 0.0 110.868 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.551 HD12 ' N ' ' A' ' 112' ' ' LEU . 10.3 mp 56.42 157.84 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.998 0.428 . . . . 0.0 110.43 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 26.7 p -78.68 165.83 23.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.302 179.936 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' ASP . . . . . 0.501 ' O ' ' N ' ' A' ' 116' ' ' HIS . 43.7 p-10 -133.75 148.73 51.43 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.45 179.815 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.518 ' O ' ' CG ' ' A' ' 116' ' ' HIS . 84.8 mtp180 53.26 -86.35 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.487 -179.706 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 116' ' ' HIS . . . . . 0.518 ' CG ' ' O ' ' A' ' 115' ' ' ARG . 44.7 p-80 40.43 71.21 1.29 Allowed Pre-proline 0 C--N 1.332 -0.157 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.583 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_exo -58.84 143.17 99.41 Favored 'Trans proline' 0 C--N 1.305 -1.735 0 C-N-CA 122.756 2.304 . . . . 0.0 112.052 -179.627 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 48.0 m -60.96 -43.32 98.93 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.478 179.82 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -67.8 142.89 56.05 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.623 179.844 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.219 -0.814 0 CA-C-O 118.072 -1.404 . . . . 0.0 110.92 -179.888 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.333 0 N-CA-C 109.549 -1.42 . . . . 0.0 109.549 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 75.0 m80 -65.67 -40.79 92.79 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.787 0.327 . . . . 0.0 110.451 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 123' ' ' GLY . . . . . 0.431 ' O ' ' O ' ' B' ' 124' ' ' VAL . . . 74.22 -169.89 53.68 Favored Glycine 0 CA--C 1.524 0.623 0 N-CA-C 111.011 -0.836 . . . . 0.0 111.011 179.897 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 124' ' ' VAL . . . . . 0.431 ' O ' ' O ' ' B' ' 123' ' ' GLY . 7.3 t 56.94 113.58 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.805 0.335 . . . . 0.0 110.475 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 125' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -121.17 125.78 48.02 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.463 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 49.22 82.07 0.04 OUTLIER Glycine 0 CA--C 1.524 0.638 0 N-CA-C 110.834 -0.907 . . . . 0.0 110.834 179.917 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 127' ' ' ARG . . . . . . . . . . . . . 61.1 ttm-85 -60.81 -43.73 97.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.747 0.308 . . . . 0.0 110.552 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 128' ' ' ASN . . . . . 0.419 ' O ' ' OD1' ' B' ' 128' ' ' ASN . 47.9 p-10 -155.33 128.08 8.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.386 179.956 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 129' ' ' ARG . . . . . 0.49 ' N ' ' CD ' ' B' ' 130' ' ' PRO . 27.4 ttm180 -171.13 51.44 0.16 Allowed Pre-proline 0 C--N 1.328 -0.366 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.475 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 130' ' ' PRO . . . . . 0.49 ' CD ' ' N ' ' B' ' 129' ' ' ARG . 37.5 Cg_endo -65.72 143.34 73.85 Favored 'Trans proline' 0 C--N 1.306 -1.694 0 C-N-CA 122.731 2.287 . . . . 0.0 111.929 179.929 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 131' ' ' SER . . . . . 0.404 ' O ' ' HB2' ' B' ' 132' ' ' ALA . 17.9 p -82.59 139.92 33.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.324 179.53 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 132' ' ' ALA . . . . . 0.404 ' HB2' ' O ' ' B' ' 131' ' ' SER . . . 178.55 150.88 0.44 Allowed Pre-proline 0 N--CA 1.449 -0.49 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.632 179.546 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 133' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -67.85 116.88 4.52 Favored 'Trans proline' 0 N--CA 1.495 1.576 0 C-N-CA 122.678 2.252 . . . . 0.0 111.793 179.344 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 37.7 mt -102.62 121.28 42.08 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.124 179.897 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 91.0 m-20 -95.99 -53.21 3.75 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-O 121.281 0.563 . . . . 0.0 110.979 179.82 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 5.6 t -57.67 -44.65 85.9 Favored 'General case' 0 C--O 1.24 0.555 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.444 -179.326 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 67.1 mm-40 -66.44 -42.17 88.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.35 179.797 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 138' ' ' ALA . . . . . 0.546 ' O ' HG23 ' B' ' 142' ' ' VAL . . . -51.7 -47.51 63.9 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.457 -0.572 . . . . 0.0 109.457 -179.049 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -61.53 -53.45 56.17 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 120.329 -0.548 . . . . 0.0 110.196 178.774 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -52.66 -47.36 67.16 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 120.74 -0.384 . . . . 0.0 111.088 179.767 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 88.6 mm-40 -56.61 -49.46 74.89 Favored 'General case' 0 C--O 1.241 0.608 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.647 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 142' ' ' VAL . . . . . 0.546 HG23 ' O ' ' B' ' 138' ' ' ALA . 80.3 t -60.94 -38.31 79.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.891 179.617 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 143' ' ' ALA . . . . . 0.697 ' HB2' HD12 ' A' ' 36' ' ' LEU . . . -64.36 -42.02 96.43 Favored 'General case' 0 C--O 1.22 -0.481 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.485 178.819 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 75.3 m -56.3 -50.05 72.54 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.914 0.388 . . . . 0.0 110.956 -178.736 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 145' ' ' THR . . . . . 0.42 ' O ' HD13 ' B' ' 149' ' ' LEU . 1.4 t -65.81 -48.96 69.94 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.925 179.82 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 146' ' ' LEU . . . . . 0.438 HD23 ' HA ' ' B' ' 146' ' ' LEU . 68.9 mt -61.44 -26.4 67.85 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.858 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 147' ' ' GLN . . . . . 0.667 ' NE2' ' NE2' ' A' ' 28' ' ' GLN . 31.0 tp60 -73.25 -59.08 2.87 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.341 179.178 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -56.24 -54.0 50.47 Favored 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 120.761 -0.375 . . . . 0.0 110.728 -179.319 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.512 ' O ' ' O ' ' B' ' 150' ' ' ALA . 7.4 mp -46.47 -34.75 5.01 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.266 -179.105 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 150' ' ' ALA . . . . . 0.512 ' O ' ' O ' ' B' ' 149' ' ' LEU . . . -57.6 -130.81 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.548 0 O-C-N 123.641 0.588 . . . . 0.0 109.955 179.381 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 151' ' ' THR . . . . . 0.49 ' O ' ' O ' ' B' ' 150' ' ' ALA . 0.7 OUTLIER 52.85 111.81 0.01 OUTLIER Pre-proline 0 CA--C 1.542 0.66 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.393 179.72 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -49.69 -57.02 2.58 Favored 'Trans proline' 0 N--CA 1.496 1.624 0 C-N-CA 122.149 1.899 . . . . 0.0 113.425 -179.381 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 61.1 p -53.36 -46.34 69.54 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.165 -178.135 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 10.6 mpt_? -61.28 -42.41 98.6 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.51 -179.623 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 155' ' ' LEU . . . . . 0.682 HD12 ' HB2' ' A' ' 24' ' ' ALA . 4.9 mt -61.58 -51.8 67.05 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 120.375 -0.53 . . . . 0.0 110.749 -179.178 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 11.4 tpt -53.91 -48.83 69.76 Favored 'General case' 0 C--O 1.24 0.6 0 C-N-CA 120.263 -0.575 . . . . 0.0 110.351 -179.664 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 157' ' ' ILE . . . . . 0.419 ' O ' ' HG2' ' B' ' 160' ' ' GLN . 96.6 mt -63.38 -45.41 98.15 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 CA-C-O 121.67 0.748 . . . . 0.0 110.395 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 52.4 mt -62.33 -38.29 88.9 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.574 179.645 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 11.7 m -59.42 -42.7 92.44 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.977 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 160' ' ' GLN . . . . . 0.703 ' OE1' HD11 ' B' ' 171' ' ' LEU . 2.9 pt20 -57.14 -44.33 83.29 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 120.384 -0.526 . . . . 0.0 110.316 179.875 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 161' ' ' LEU . . . . . 0.596 ' N ' ' HG2' ' B' ' 160' ' ' GLN . 13.9 mt -64.55 -37.25 86.89 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.254 -179.335 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 162' ' ' ARG . . . . . . . . . . . . . 73.5 ttp85 -52.19 -38.2 57.11 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.323 -179.363 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 49.8 t-20 -56.32 -40.76 74.9 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.86 0.362 . . . . 0.0 110.212 -179.655 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . 153.18 178.07 27.37 Favored Glycine 0 CA--C 1.524 0.612 0 N-CA-C 111.17 -0.772 . . . . 0.0 111.17 179.09 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_exo -69.08 143.83 55.52 Favored 'Trans proline' 0 C--N 1.312 -1.382 0 C-N-CA 122.764 2.309 . . . . 0.0 112.103 -179.723 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 166' ' ' LEU . . . . . 0.568 ' O ' HD12 ' B' ' 166' ' ' LEU . 0.3 OUTLIER -165.69 159.48 13.42 Favored Pre-proline 0 C--N 1.326 -0.427 0 C-N-CA 120.336 -0.546 . . . . 0.0 110.714 179.682 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -63.81 142.53 83.04 Favored 'Trans proline' 0 N--CA 1.495 1.598 0 C-N-CA 122.413 2.075 . . . . 0.0 112.367 178.782 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . 48.0 t -62.69 -42.85 97.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.398 179.437 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 169' ' ' THR . . . . . 0.46 HG23 HE22 ' B' ' 179' ' ' GLN . 17.0 m -55.83 -69.18 0.15 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.817 -179.608 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 47.6 t0 -52.39 -40.42 62.05 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-O 121.362 0.601 . . . . 0.0 109.818 -179.18 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 171' ' ' LEU . . . . . 0.728 ' C ' HD13 ' B' ' 171' ' ' LEU . 2.9 tm? -59.59 -47.95 83.55 Favored 'General case' 0 N--CA 1.439 -0.975 0 C-N-CA 119.707 -0.797 . . . . 0.0 110.413 -179.589 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 172' ' ' ALA . . . . . 0.553 ' O ' ' N ' ' B' ' 177' ' ' MET . . . -56.36 -39.69 73.31 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.345 0.593 . . . . 0.0 110.252 -179.444 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -64.3 -28.45 69.72 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.575 179.312 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 174' ' ' ALA . . . . . 0.419 ' HB3' ' O ' ' B' ' 171' ' ' LEU . . . -63.64 -41.0 98.28 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.093 -179.921 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 6.0 tt -168.72 -33.5 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.895 -179.392 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . -54.78 -63.87 4.85 Favored Glycine 0 CA--C 1.523 0.552 0 C-N-CA 120.812 -0.709 . . . . 0.0 111.472 -178.156 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 177' ' ' MET . . . . . 0.553 ' N ' ' O ' ' B' ' 172' ' ' ALA . 3.4 mmt 56.07 29.22 14.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.716 0.293 . . . . 0.0 110.269 -179.917 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 86.4 mt-10 -155.35 60.87 0.63 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.36 -179.575 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 179' ' ' GLN . . . . . 0.46 HE22 HG23 ' B' ' 169' ' ' THR . 18.0 mt-30 -47.1 -28.19 1.66 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.504 -179.583 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 48.0 m -69.92 -45.4 67.62 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.769 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -65.02 -32.21 73.83 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.437 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 63.5 t -70.22 -50.5 46.44 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.266 0 C-N-CA 120.873 -0.331 . . . . 0.0 110.755 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 13.5 t -58.7 -41.81 87.13 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.217 -179.856 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -62.6 -50.97 69.16 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-O 121.089 0.471 . . . . 0.0 110.779 -179.963 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -64.12 -34.12 77.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.145 179.831 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 7.2 tp -63.47 -45.15 92.12 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.172 179.906 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -61.81 -41.74 98.14 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.752 0.31 . . . . 0.0 110.262 -179.951 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 83.9 t -64.07 -54.67 28.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 C-N-CA 120.107 -0.637 . . . . 0.0 110.474 -179.834 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 93.0 mt -61.07 -39.07 88.5 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 -179.445 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 73.0 ttt-85 -58.72 -40.43 83.73 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.482 179.746 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 17.6 m120 -58.17 -46.43 85.74 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.674 -0.41 . . . . 0.0 110.442 -179.468 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 192' ' ' LEU . . . . . 0.519 ' N ' HD22 ' B' ' 192' ' ' LEU . 3.9 mm? -66.49 -41.01 89.59 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.631 179.4 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 108.74 34.57 2.59 Favored Glycine 0 CA--C 1.524 0.608 0 N-CA-C 111.015 -0.834 . . . . 0.0 111.015 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 194' ' ' LEU . . . . . 0.505 HD22 ' N ' ' B' ' 194' ' ' LEU . 3.9 mm? -92.31 -17.6 24.5 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.82 0.343 . . . . 0.0 110.519 179.942 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 27.5 m -137.29 160.49 35.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.232 179.864 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 196' ' ' VAL . . . . . . . . . . . . . 50.4 t -135.49 143.59 36.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.284 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 197' ' ' GLY . . . . . . . . . . . . . . . -117.09 141.15 16.45 Favored Glycine 0 CA--C 1.523 0.575 0 N-CA-C 110.643 -0.983 . . . . 0.0 110.643 179.605 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -118.11 105.49 11.88 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 120.864 0.364 . . . . 0.0 110.466 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 61.2 ttt85 -75.46 123.94 26.29 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.18 179.82 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 200' ' ' ALA . . . . . . . . . . . . . . . -130.94 145.41 52.02 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.396 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 201' ' ' GLY . . . . . . . . . . . . . . . -44.21 -38.23 4.85 Favored Glycine 0 CA--C 1.523 0.54 0 N-CA-C 110.666 -0.974 . . . . 0.0 110.666 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 202' ' ' ARG . . . . . . . . . . . . . 63.1 ttm-85 -68.29 -45.32 73.39 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.763 -0.375 . . . . 0.0 110.57 179.699 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 3.6 m 177.44 176.73 0.37 Allowed 'General case' 0 N--CA 1.454 -0.249 0 CA-C-O 121.097 0.475 . . . . 0.0 109.902 -179.652 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 2.4 tp -96.98 133.65 37.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.689 178.917 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 58.5 t -114.75 135.31 55.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.189 179.38 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 -111.85 133.84 53.8 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.429 179.691 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 45.5 t -151.78 172.33 16.31 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.211 179.902 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . 56.8 mt -69.11 147.72 51.02 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.56 -179.729 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 7.2 t80 -54.56 -46.29 73.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.257 -179.768 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 210' ' ' ASP . . . . . 0.509 ' OD2' ' CD2' ' B' ' 212' ' ' HIS . 45.2 t0 -147.91 170.58 17.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.557 -179.665 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 211' ' ' THR . . . . . 0.492 ' O ' ' HB3' ' B' ' 214' ' ' ALA . 81.6 p -80.14 -19.36 47.41 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.63 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 212' ' ' HIS . . . . . 0.509 ' CD2' ' OD2' ' B' ' 210' ' ' ASP . 22.3 m170 -43.38 -65.84 0.45 Allowed 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.159 0.504 . . . . 0.0 110.738 -179.851 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 213' ' ' VAL . . . . . 0.427 HG23 ' N ' ' B' ' 214' ' ' ALA . 29.4 m -50.41 -36.8 13.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.214 -179.667 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 214' ' ' ALA . . . . . 0.492 ' HB3' ' O ' ' B' ' 211' ' ' THR . . . -63.16 -40.28 97.1 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.501 179.673 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 97.4 mm-40 -62.36 -45.89 91.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.987 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 216' ' ' LEU . . . . . . . . . . . . . 15.3 tp -59.62 -43.55 93.76 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.227 -0.589 . . . . 0.0 110.02 -179.551 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 56.1 tp -63.89 -39.58 94.5 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.046 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 99.9 m-20 -59.41 -44.04 92.9 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.352 -179.599 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 219' ' ' GLU . . . . . . . . . . . . . 67.7 mm-40 -66.26 -44.02 84.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.457 179.105 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -59.32 -44.17 92.61 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 179.284 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 4.7 mm -63.36 -44.01 98.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 121.158 0.504 . . . . 0.0 110.457 -179.886 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 222' ' ' TYR . . . . . 0.441 ' O ' ' CG ' ' B' ' 226' ' ' HIS . 3.8 m-85 -61.2 -42.83 99.29 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.111 -179.801 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 223' ' ' HIS . . . . . 0.629 ' ND1' ' N ' ' B' ' 224' ' ' SER . 0.0 OUTLIER -68.76 -36.37 78.25 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.061 0.458 . . . . 0.0 110.228 179.431 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 224' ' ' SER . . . . . 0.629 ' N ' ' ND1' ' B' ' 223' ' ' HIS . 41.6 t -58.84 -49.09 79.04 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.122 -178.097 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 9.6 tm-20 -75.58 -54.42 7.02 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.955 179.135 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 226' ' ' HIS . . . . . 0.441 ' CG ' ' O ' ' B' ' 222' ' ' TYR . 4.7 m-70 -48.1 -26.89 2.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.21 -178.695 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 227' ' ' LEU . . . . . 0.433 HD12 ' CD2' ' B' ' 223' ' ' HIS . 57.9 mt -112.84 -68.32 0.94 Allowed 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.48 179.302 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 228' ' ' HIS . . . . . 0.531 ' N ' ' O ' ' B' ' 224' ' ' SER . 52.1 t-80 56.38 69.89 0.7 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.542 179.97 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 229' ' ' LEU . . . . . . . . . . . . . 59.6 mt -63.42 -40.32 96.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.517 179.786 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 230' ' ' GLY . . . . . 0.438 ' O ' ' O ' ' B' ' 231' ' ' LEU . . . 78.88 -159.22 45.52 Favored Glycine 0 CA--C 1.524 0.597 0 N-CA-C 110.803 -0.919 . . . . 0.0 110.803 -179.955 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 231' ' ' LEU . . . . . 0.554 ' N ' HD12 ' B' ' 231' ' ' LEU . 10.3 mp 56.3 156.75 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.06 0.457 . . . . 0.0 110.403 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 232' ' ' SER . . . . . . . . . . . . . 27.1 p -78.66 162.98 25.84 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.405 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 233' ' ' ASP . . . . . 0.46 ' O ' ' N ' ' B' ' 235' ' ' HIS . 44.5 p-10 -130.93 148.4 52.69 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.448 179.907 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 234' ' ' ARG . . . . . 0.524 ' O ' ' CG ' ' B' ' 235' ' ' HIS . 85.0 mtp180 53.88 -87.47 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.551 -179.884 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 235' ' ' HIS . . . . . 0.524 ' CG ' ' O ' ' B' ' 234' ' ' ARG . 46.9 p-80 40.43 71.63 1.2 Allowed Pre-proline 0 N--CA 1.462 0.173 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.566 -179.796 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 236' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -58.31 144.0 96.61 Favored 'Trans proline' 0 C--N 1.305 -1.711 0 C-N-CA 122.757 2.305 . . . . 0.0 112.042 -179.693 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 237' ' ' SER . . . . . . . . . . . . . 68.1 m -60.68 -43.55 97.56 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.52 179.777 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 238' ' ' ALA . . . . . . . . . . . . . . . -69.73 146.19 51.7 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.583 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.725 0 CA-C-O 117.993 -1.448 . . . . 0.0 110.919 -179.985 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.316 0 N-CA-C 109.546 -1.421 . . . . 0.0 109.546 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 94.0 m-70 -61.75 -40.71 96.1 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.832 0.349 . . . . 0.0 110.65 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -64.24 -43.71 96.62 Favored Glycine 0 CA--C 1.523 0.556 0 N-CA-C 111.057 -0.817 . . . . 0.0 111.057 -179.845 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 14.6 p -142.63 142.71 26.48 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.255 0 CA-C-O 120.862 0.363 . . . . 0.0 110.527 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -59.64 142.46 52.86 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.292 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -47.0 159.54 0.37 Allowed Glycine 0 CA--C 1.522 0.469 0 N-CA-C 110.872 -0.891 . . . . 0.0 110.872 -179.864 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 80.1 mtp85 -82.79 128.27 34.24 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.7 0.286 . . . . 0.0 110.302 -179.872 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -103.73 5.01 35.9 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.656 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.592 ' N ' ' CD ' ' A' ' 11' ' ' PRO . 2.6 ttp85 -74.71 -44.55 5.3 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 116.287 -0.415 . . . . 0.0 109.944 179.792 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.592 ' CD ' ' N ' ' A' ' 10' ' ' ARG . 22.4 Cg_exo -63.16 146.82 94.39 Favored 'Trans proline' 0 C--N 1.308 -1.565 0 C-N-CA 122.816 2.344 . . . . 0.0 111.625 -179.748 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 40.5 m -149.04 152.42 36.2 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.321 179.475 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 64.07 70.92 0.63 Allowed Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.738 -179.871 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_exo -60.95 143.76 99.42 Favored 'Trans proline' 0 C--N 1.306 -1.669 0 C-N-CA 122.945 2.43 . . . . 0.0 111.802 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.546 ' O ' ' N ' ' A' ' 17' ' ' SER . 31.3 mt -82.73 115.42 21.65 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.972 179.776 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.506 ' O ' ' N ' ' A' ' 19' ' ' ALA . 19.1 t70 -41.02 -18.92 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.82 179.907 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.546 ' N ' ' O ' ' A' ' 15' ' ' LEU . 42.2 t -38.72 -42.33 0.79 Allowed 'General case' 0 C--O 1.241 0.657 0 CA-C-O 121.375 0.607 . . . . 0.0 110.381 -179.961 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 54.6 mt-30 -65.32 -43.3 91.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.164 179.022 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.506 ' N ' ' O ' ' A' ' 16' ' ' ASP . . . -62.61 -31.44 72.28 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.108 179.639 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.88 -53.27 53.21 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 179.683 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.37 -46.14 83.69 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.489 -0.484 . . . . 0.0 110.81 179.365 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 59.3 tt0 -56.1 -51.11 69.07 Favored 'General case' 0 C--O 1.242 0.668 0 CA-C-O 121.544 0.687 . . . . 0.0 110.38 -179.778 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 75.2 t -62.41 -43.31 98.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.753 179.558 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.461 ' HB2' HD12 ' B' ' 155' ' ' LEU . . . -49.39 -50.22 41.22 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.299 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 58.1 m -59.18 -42.34 90.59 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 91.2 m -63.31 -50.92 68.13 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 120.363 -0.535 . . . . 0.0 111.105 179.869 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 96.0 mt -68.35 -22.16 64.69 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.56 -179.739 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.502 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 49.5 tt0 -74.69 -58.0 3.57 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.281 179.559 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.6 -54.14 50.38 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.722 -0.391 . . . . 0.0 110.283 -179.731 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.496 ' O ' ' O ' ' A' ' 31' ' ' ALA . 77.1 mt -44.91 -33.14 1.86 Allowed 'General case' 0 CA--C 1.513 -0.481 0 C-N-CA 121.024 -0.27 . . . . 0.0 110.458 -179.198 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.502 ' HB3' ' O ' ' A' ' 28' ' ' GLN . . . -57.61 -128.27 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.12 179.233 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.47 ' HG1' ' HB3' ' A' ' 35' ' ' ARG . 0.6 OUTLIER 54.26 107.18 0.03 OUTLIER Pre-proline 0 CA--C 1.54 0.579 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.571 -179.959 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -49.27 -58.68 1.6 Allowed 'Trans proline' 0 N--CA 1.496 1.663 0 C-N-CA 122.165 1.91 . . . . 0.0 113.429 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 78.4 p -55.54 -43.33 75.69 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.802 -179.149 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.47 ' HB3' ' HG1' ' A' ' 32' ' ' THR . 44.4 ttm180 -61.06 -44.29 97.61 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 120.817 -0.353 . . . . 0.0 110.663 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.468 HD12 ' HB2' ' B' ' 143' ' ' ALA . 7.1 mt -61.03 -45.74 93.57 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.467 -0.493 . . . . 0.0 110.908 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.614 ' SD ' HD11 ' A' ' 56' ' ' ILE . 0.0 OUTLIER -55.21 -46.79 75.91 Favored 'General case' 0 C--N 1.319 -0.741 0 C-N-CA 120.15 -0.62 . . . . 0.0 110.163 -179.886 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.484 ' CD1' ' OE1' ' A' ' 66' ' ' GLN . 65.0 mt -63.72 -45.34 97.59 Favored 'Isoleucine or valine' 0 C--O 1.239 0.532 0 CA-C-O 121.601 0.715 . . . . 0.0 110.734 -179.824 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -63.28 -40.95 98.83 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.765 179.827 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.437 ' OG1' ' O ' ' A' ' 37' ' ' MET . 15.3 p -61.42 -37.34 83.15 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.944 179.974 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 19.8 mm-40 -62.1 -47.46 84.53 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.516 -0.474 . . . . 0.0 109.855 179.335 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 29.3 mt -64.54 -35.39 80.8 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.762 179.525 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 62.5 ttp180 -55.15 -31.94 61.73 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.57 -179.521 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 98.4 m-20 -61.15 -41.03 96.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.507 -179.647 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.42 ' O ' ' CD2' ' A' ' 47' ' ' LEU . . . 155.83 -160.38 29.96 Favored Glycine 0 CA--C 1.528 0.847 0 N-CA-C 110.951 -0.86 . . . . 0.0 110.951 180.0 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_exo -61.67 144.08 97.07 Favored 'Trans proline' 0 C--N 1.309 -1.528 0 C-N-CA 122.96 2.44 . . . . 0.0 111.976 179.499 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.43 HD12 ' O ' ' A' ' 47' ' ' LEU . 0.3 OUTLIER 176.95 94.21 0.12 Allowed Pre-proline 0 CA--C 1.538 0.507 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.353 179.706 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo -48.32 177.88 0.01 OUTLIER 'Trans proline' 0 C--N 1.297 -2.155 0 C-N-CA 122.282 1.988 . . . . 0.0 112.485 -179.737 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.521 HG23 ' N ' ' A' ' 50' ' ' THR . 4.7 m -59.97 -42.39 89.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 121.51 0.671 . . . . 0.0 110.367 -179.759 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.521 ' N ' HG23 ' A' ' 49' ' ' VAL . 11.1 m -59.87 -41.4 91.43 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.007 -0.997 . . . . 0.0 110.537 179.641 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -73.95 -46.58 43.21 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.702 179.57 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.682 HD23 ' O ' ' A' ' 52' ' ' LEU . 5.2 tt -61.42 -45.52 93.97 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.586 -179.281 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.86 -46.33 78.85 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.666 -0.414 . . . . 0.0 111.281 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -55.61 -35.81 66.27 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.138 -179.429 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 0.484 ' O ' HG23 ' A' ' 56' ' ' ILE . . . -50.96 -59.59 3.98 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.516 -0.473 . . . . 0.0 110.708 -179.291 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.614 HD11 ' SD ' ' A' ' 37' ' ' MET . 2.2 pp -158.84 -18.17 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.605 -179.704 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -58.84 -64.78 3.98 Favored Glycine 0 CA--C 1.523 0.552 0 N-CA-C 111.209 -0.756 . . . . 0.0 111.209 -179.171 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.488 ' O ' ' SD ' ' A' ' 58' ' ' MET . 0.0 OUTLIER 67.73 40.45 2.45 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.713 0.292 . . . . 0.0 110.328 179.996 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.477 ' O ' ' N ' ' A' ' 61' ' ' SER . 72.1 tt0 -169.01 60.86 0.05 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 13.1 mt-30 -41.45 -23.12 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.766 -179.434 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.477 ' N ' ' O ' ' A' ' 59' ' ' GLU . 69.3 m -68.7 -43.34 76.24 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.917 179.923 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.461 ' H ' ' HG2' ' A' ' 59' ' ' GLU . . . -68.12 -30.5 69.66 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.628 -179.888 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 59.4 t -72.18 -51.59 29.27 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.294 0 C-N-CA 120.882 -0.327 . . . . 0.0 110.845 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 40.8 t -59.8 -42.28 93.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.33 -179.738 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -62.82 -51.21 67.92 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-O 120.986 0.422 . . . . 0.0 110.995 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.484 ' OE1' ' CD1' ' A' ' 38' ' ' ILE . 73.5 mt-30 -63.66 -36.87 85.27 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.055 0.455 . . . . 0.0 110.471 179.968 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 5.9 tt -62.1 -43.75 98.15 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.479 -179.76 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -62.97 -41.79 99.64 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.862 0.363 . . . . 0.0 110.434 179.459 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 75.5 t -61.52 -54.18 38.42 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.206 0 C-N-CA 119.88 -0.728 . . . . 0.0 110.134 -179.726 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 94.9 mt -62.31 -37.31 85.09 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.175 0.512 . . . . 0.0 109.851 -179.561 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 7.4 tmm_? -57.34 -38.82 74.71 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.454 -179.842 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 99.0 m-20 -62.07 -41.09 97.81 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.421 -179.823 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.447 HD23 ' N ' ' A' ' 73' ' ' LEU . 7.2 mt -66.02 -39.11 89.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.242 -179.488 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 102.79 31.72 5.03 Favored Glycine 0 CA--C 1.525 0.678 0 N-CA-C 111.011 -0.836 . . . . 0.0 111.011 -179.839 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 83.9 mt -95.04 -15.7 23.26 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 120.751 0.31 . . . . 0.0 110.701 179.774 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 33.4 m -136.88 160.7 36.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.088 179.855 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 40.3 t -137.71 150.42 25.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.345 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -124.74 145.89 15.94 Favored Glycine 0 CA--C 1.52 0.397 0 N-CA-C 110.237 -1.145 . . . . 0.0 110.237 179.437 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -120.48 104.64 10.15 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 120.827 0.346 . . . . 0.0 110.469 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 60.1 ttp180 -77.44 125.91 30.07 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.984 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -138.15 148.27 44.74 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.267 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -43.84 -35.36 3.23 Favored Glycine 0 CA--C 1.521 0.417 0 N-CA-C 110.538 -1.025 . . . . 0.0 110.538 -179.707 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 8.5 tpm_? -70.99 -46.72 61.8 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.687 -0.405 . . . . 0.0 110.688 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 3.2 m 176.24 176.8 0.26 Allowed 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 121.193 0.521 . . . . 0.0 109.709 -179.548 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 1.1 tp -102.72 122.6 55.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.567 178.745 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 78.8 t -101.95 129.79 52.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.173 179.055 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 -104.86 129.94 53.09 Favored 'General case' 0 CA--C 1.52 -0.181 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 50.7 m -149.24 171.38 16.58 Favored 'General case' 0 N--CA 1.462 0.151 0 N-CA-C 110.049 -0.352 . . . . 0.0 110.049 -179.685 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 17.7 mt -67.98 148.96 50.33 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.428 -179.304 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -52.01 -44.92 64.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.2 -179.582 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.451 ' CG ' ' H ' ' A' ' 92' ' ' THR . 13.2 t70 -147.44 -177.55 5.76 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.327 -179.97 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' THR . . . . . 0.451 ' H ' ' CG ' ' A' ' 91' ' ' ASP . 6.6 p -90.86 -13.46 33.65 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.576 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 40.1 m80 -48.74 -65.08 0.63 Allowed 'General case' 0 C--O 1.235 0.323 0 CA-C-O 120.809 0.337 . . . . 0.0 110.712 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.46 HG23 ' N ' ' A' ' 95' ' ' ALA . 27.2 m -50.74 -38.79 17.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.062 -179.684 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.46 ' N ' HG23 ' A' ' 94' ' ' VAL . . . -61.66 -41.07 97.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.338 179.778 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 64.6 tp60 -61.92 -45.72 92.46 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.866 -179.615 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 13.0 tp -59.4 -42.32 91.47 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.584 -0.446 . . . . 0.0 110.133 -179.257 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 92.7 mt -63.33 -40.23 96.73 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.149 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' ASP . . . . . 0.435 ' OD1' ' CE1' ' A' ' 103' ' ' TYR . 65.7 t0 -60.22 -42.58 95.49 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.201 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -67.09 -50.22 62.33 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.491 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -56.19 -43.28 78.3 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 179.621 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 4.6 mm -62.48 -43.69 98.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 C-N-CA 120.384 -0.526 . . . . 0.0 110.439 -179.735 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' TYR . . . . . 0.435 ' CE1' ' OD1' ' A' ' 99' ' ' ASP . 3.3 m-85 -58.87 -41.31 86.77 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.868 -179.942 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 68.7 t60 -65.8 -38.78 89.89 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.619 179.501 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 43.2 t -58.96 -46.32 88.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.24 -179.638 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -75.01 -58.05 3.52 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.008 0.432 . . . . 0.0 110.954 179.228 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 84.7 t60 -50.75 -34.46 27.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.725 -0.671 . . . . 0.0 109.735 -179.341 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 7.0 tp -152.64 104.24 2.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.484 179.432 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' HIS . . . . . 0.574 ' ND1' ' N ' ' A' ' 109' ' ' HIS . 0.0 OUTLIER -97.07 -74.58 0.57 Allowed 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.237 179.881 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.5 ' N ' HD22 ' A' ' 110' ' ' LEU . 4.3 mm? 49.0 11.63 0.04 OUTLIER 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.304 -179.714 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 111' ' ' GLY . . . . . 0.494 ' H ' ' C ' ' A' ' 109' ' ' HIS . . . -86.12 -3.31 85.18 Favored Glycine 0 CA--C 1.525 0.7 0 N-CA-C 110.914 -0.875 . . . . 0.0 110.914 179.86 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 81.6 mt -69.38 -17.08 63.64 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.993 0.425 . . . . 0.0 110.414 -179.508 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.492 ' OG ' ' N ' ' A' ' 114' ' ' ASP . 78.7 p -62.81 -69.35 0.27 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.552 -179.859 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 114' ' ' ASP . . . . . 0.492 ' N ' ' OG ' ' A' ' 113' ' ' SER . 62.6 t0 40.73 66.4 0.64 Allowed 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.779 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 20.6 mmm180 -62.83 -42.4 99.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.491 -179.558 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER 40.14 77.57 0.41 Allowed Pre-proline 0 C--N 1.331 -0.236 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.62 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_exo -56.15 141.12 87.9 Favored 'Trans proline' 0 C--N 1.307 -1.615 0 C-N-CA 122.647 2.231 . . . . 0.0 112.116 -179.628 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 39.5 t -62.48 -44.22 96.93 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.552 179.83 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . 46.58 -171.75 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.615 -179.843 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.774 0 CA-C-O 117.997 -1.446 . . . . 0.0 110.937 -179.865 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.393 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 94.8 m-70 -65.85 -39.79 91.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.76 0.314 . . . . 0.0 110.511 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 123' ' ' GLY . . . . . . . . . . . . . . . -64.17 -43.03 97.72 Favored Glycine 0 CA--C 1.524 0.638 0 N-CA-C 111.046 -0.821 . . . . 0.0 111.046 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 14.8 p -144.22 142.55 24.0 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.188 0 CA-C-O 120.829 0.347 . . . . 0.0 110.617 179.921 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 125' ' ' GLU . . . . . . . . . . . . . 73.9 mm-40 -58.56 146.91 34.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.51 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -50.39 160.89 1.24 Allowed Glycine 0 CA--C 1.524 0.604 0 N-CA-C 110.774 -0.931 . . . . 0.0 110.774 -179.808 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 127' ' ' ARG . . . . . . . . . . . . . 80.7 mtp85 -86.82 126.39 34.6 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.905 0.383 . . . . 0.0 110.487 -179.859 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 128' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -103.12 2.74 35.03 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.637 179.8 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 129' ' ' ARG . . . . . 0.565 ' N ' ' CD ' ' B' ' 130' ' ' PRO . 1.8 ttp85 -68.76 -45.81 33.26 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.609 179.373 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 130' ' ' PRO . . . . . 0.565 ' CD ' ' N ' ' B' ' 129' ' ' ARG . 60.9 Cg_endo -79.24 143.85 17.9 Favored 'Trans proline' 0 C--N 1.31 -1.485 0 C-N-CA 122.531 2.154 . . . . 0.0 111.916 -178.651 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 66.6 m -142.83 162.43 35.48 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.477 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 132' ' ' ALA . . . . . . . . . . . . . . . 62.22 72.01 0.67 Allowed Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.577 -179.77 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 133' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -69.25 147.15 65.5 Favored 'Trans proline' 0 N--CA 1.492 1.418 0 C-N-CA 122.715 2.277 . . . . 0.0 111.846 -179.544 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 134' ' ' LEU . . . . . 0.54 ' O ' ' N ' ' B' ' 136' ' ' SER . 24.2 mt -80.47 119.7 23.5 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.232 -179.811 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 135' ' ' ASP . . . . . 0.498 ' O ' ' N ' ' B' ' 138' ' ' ALA . 20.3 t70 -41.94 -17.84 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.758 179.681 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 136' ' ' SER . . . . . 0.54 ' N ' ' O ' ' B' ' 134' ' ' LEU . 25.8 t -38.47 -42.05 0.71 Allowed 'General case' 0 C--O 1.242 0.659 0 CA-C-O 121.218 0.533 . . . . 0.0 110.484 -179.722 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 74.9 mt-30 -65.45 -43.59 89.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.041 179.146 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 138' ' ' ALA . . . . . 0.498 ' N ' ' O ' ' B' ' 135' ' ' ASP . . . -62.97 -31.34 72.43 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.211 179.729 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -64.12 -53.11 54.75 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 120.957 0.408 . . . . 0.0 109.901 179.677 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -57.63 -46.78 83.7 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.737 179.424 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -55.9 -50.02 71.83 Favored 'General case' 0 C--O 1.242 0.67 0 CA-C-O 121.563 0.697 . . . . 0.0 110.171 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 142' ' ' VAL . . . . . 0.407 HG23 ' O ' ' B' ' 138' ' ' ALA . 77.7 t -62.61 -43.56 98.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.688 179.611 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 143' ' ' ALA . . . . . 0.468 ' HB2' HD12 ' A' ' 36' ' ' LEU . . . -49.63 -49.27 47.73 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.418 179.888 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 55.2 m -59.17 -43.0 92.12 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.33 -0.395 . . . . 0.0 109.977 179.867 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 89.0 m -63.27 -50.39 70.33 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 120.386 -0.526 . . . . 0.0 110.995 179.906 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 96.0 mt -68.82 -22.78 64.22 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.799 -179.785 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 147' ' ' GLN . . . . . 0.485 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 49.9 tt0 -74.62 -57.63 3.8 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.402 179.483 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -58.63 -54.13 50.52 Favored 'General case' 0 CA--C 1.519 -0.227 0 C-N-CA 120.57 -0.452 . . . . 0.0 110.388 -179.579 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.501 ' O ' ' O ' ' B' ' 150' ' ' ALA . 77.5 mt -45.26 -33.53 2.42 Favored 'General case' 0 CA--C 1.513 -0.465 0 C-N-CA 121.021 -0.272 . . . . 0.0 110.441 -178.969 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 150' ' ' ALA . . . . . 0.501 ' O ' ' O ' ' B' ' 149' ' ' LEU . . . -57.1 -128.35 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.238 0.542 . . . . 0.0 110.309 179.363 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 151' ' ' THR . . . . . 0.495 ' HG1' ' C ' ' B' ' 150' ' ' ALA . 0.6 OUTLIER 54.3 108.61 0.02 OUTLIER Pre-proline 0 CA--C 1.541 0.623 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.558 -179.722 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -49.73 -59.18 1.32 Allowed 'Trans proline' 0 N--CA 1.494 1.555 0 C-N-CA 122.197 1.931 . . . . 0.0 113.317 179.73 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 84.3 p -54.92 -43.96 73.78 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.812 -179.101 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 44.2 ttm180 -60.79 -44.43 96.84 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.574 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 155' ' ' LEU . . . . . 0.461 HD12 ' HB2' ' A' ' 24' ' ' ALA . 7.2 mt -60.92 -46.16 91.78 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.365 -0.534 . . . . 0.0 110.694 -179.926 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 156' ' ' MET . . . . . 0.634 ' SD ' HD11 ' B' ' 175' ' ' ILE . 0.0 OUTLIER -54.58 -47.22 73.56 Favored 'General case' 0 C--N 1.318 -0.764 0 C-N-CA 120.116 -0.634 . . . . 0.0 110.131 -179.91 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 157' ' ' ILE . . . . . 0.452 ' CD1' ' OE1' ' B' ' 185' ' ' GLN . 67.4 mt -63.61 -45.78 96.64 Favored 'Isoleucine or valine' 0 C--O 1.239 0.544 0 CA-C-O 121.483 0.658 . . . . 0.0 110.808 -179.757 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -63.01 -40.45 97.81 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.866 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 159' ' ' THR . . . . . 0.443 HG23 ' O ' ' B' ' 155' ' ' LEU . 18.1 p -61.22 -38.17 85.66 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 116.088 -0.505 . . . . 0.0 109.938 -180.0 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 12.9 mm-40 -61.52 -47.29 86.27 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.549 -0.46 . . . . 0.0 109.923 179.395 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 161' ' ' LEU . . . . . . . . . . . . . 29.4 mt -64.71 -34.79 79.15 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.837 179.622 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 162' ' ' ARG . . . . . . . . . . . . . 62.6 ttp180 -56.3 -30.79 62.97 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.674 -179.46 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 98.1 m-20 -61.74 -41.1 97.21 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.462 -179.631 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 164' ' ' GLY . . . . . 0.427 ' O ' ' CD2' ' B' ' 166' ' ' LEU . . . 156.49 -160.44 30.22 Favored Glycine 0 CA--C 1.526 0.755 0 N-CA-C 110.887 -0.885 . . . . 0.0 110.887 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_exo -62.13 143.25 94.37 Favored 'Trans proline' 0 C--N 1.308 -1.556 0 C-N-CA 123.016 2.477 . . . . 0.0 112.024 179.434 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 166' ' ' LEU . . . . . 0.427 ' CD2' ' O ' ' B' ' 164' ' ' GLY . 0.3 OUTLIER 177.96 95.13 0.14 Allowed Pre-proline 0 CA--C 1.538 0.499 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.408 179.682 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_exo -48.51 177.94 0.02 OUTLIER 'Trans proline' 0 C--N 1.299 -2.075 0 C-N-CA 122.353 2.035 . . . . 0.0 112.377 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 168' ' ' VAL . . . . . 0.514 HG23 ' N ' ' B' ' 169' ' ' THR . 4.2 m -59.87 -42.36 88.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 121.589 0.709 . . . . 0.0 110.388 -179.728 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 169' ' ' THR . . . . . 0.514 ' N ' HG23 ' B' ' 168' ' ' VAL . 9.8 m -59.48 -40.84 88.29 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.454 179.902 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -74.11 -46.33 43.41 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.759 179.517 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 171' ' ' LEU . . . . . 0.681 HD23 ' O ' ' B' ' 171' ' ' LEU . 4.8 tt -61.64 -44.2 97.43 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.348 -178.971 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 172' ' ' ALA . . . . . . . . . . . . . . . -67.35 -46.94 71.91 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.131 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 82.3 tt0 -54.93 -36.38 65.2 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.219 -179.479 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 174' ' ' ALA . . . . . 0.506 ' O ' HG23 ' B' ' 175' ' ' ILE . . . -51.15 -59.6 4.01 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.463 -0.495 . . . . 0.0 110.821 -179.19 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 175' ' ' ILE . . . . . 0.634 HD11 ' SD ' ' B' ' 156' ' ' MET . 2.2 pp -159.08 -17.4 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.567 -179.493 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . -60.12 -64.17 4.4 Favored Glycine 0 CA--C 1.524 0.595 0 N-CA-C 111.112 -0.795 . . . . 0.0 111.112 -179.347 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 177' ' ' MET . . . . . 0.495 ' O ' ' SD ' ' B' ' 177' ' ' MET . 0.0 OUTLIER 66.71 40.78 3.16 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.707 0.289 . . . . 0.0 110.268 179.927 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 178' ' ' GLU . . . . . 0.49 ' O ' ' N ' ' B' ' 180' ' ' SER . 71.9 tt0 -168.33 60.41 0.06 Allowed 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 179.919 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 13.2 mt-30 -41.27 -22.82 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.766 -179.378 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 180' ' ' SER . . . . . 0.49 ' N ' ' O ' ' B' ' 178' ' ' GLU . 49.1 m -68.84 -43.85 74.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.99 179.831 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 181' ' ' ALA . . . . . 0.485 ' H ' ' HG2' ' B' ' 178' ' ' GLU . . . -68.02 -30.16 69.34 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.591 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 57.9 t -72.03 -51.66 29.49 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 C-N-CA 120.811 -0.356 . . . . 0.0 110.893 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 6.5 t -59.54 -42.61 92.73 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.255 -179.763 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -62.85 -50.69 69.95 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 120.931 0.396 . . . . 0.0 110.979 -179.961 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 185' ' ' GLN . . . . . 0.452 ' OE1' ' CD1' ' B' ' 157' ' ' ILE . 74.2 mt-30 -63.62 -36.72 84.75 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.533 179.915 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 5.8 tt -62.79 -44.07 97.14 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.662 -179.818 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -62.51 -41.78 99.06 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.413 179.607 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 76.8 t -61.66 -54.26 37.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 C-N-CA 119.881 -0.728 . . . . 0.0 110.174 -179.765 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 86.6 mt -62.26 -37.49 85.65 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.233 0.54 . . . . 0.0 109.954 -179.517 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 7.3 tmm_? -56.93 -40.07 75.67 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.454 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -61.33 -41.28 96.77 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.881 0.372 . . . . 0.0 110.325 -179.512 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 192' ' ' LEU . . . . . 0.463 ' N ' HD23 ' B' ' 192' ' ' LEU . 7.3 mt -65.53 -38.89 90.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.398 -179.508 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 102.46 30.26 5.67 Favored Glycine 0 CA--C 1.524 0.633 0 N-CA-C 110.857 -0.897 . . . . 0.0 110.857 -179.844 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 94.6 mt -93.66 -16.37 24.37 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.85 0.357 . . . . 0.0 110.689 179.905 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 35.7 m -136.53 160.47 37.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.323 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 196' ' ' VAL . . . . . . . . . . . . . 42.8 t -138.42 152.38 25.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.159 179.783 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 197' ' ' GLY . . . . . . . . . . . . . . . -127.44 147.64 17.15 Favored Glycine 0 CA--C 1.523 0.565 0 N-CA-C 110.448 -1.061 . . . . 0.0 110.448 179.685 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -119.97 106.63 12.21 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 120.897 0.38 . . . . 0.0 110.524 179.937 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 59.7 ttp180 -79.88 123.43 27.75 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.191 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 200' ' ' ALA . . . . . . . . . . . . . . . -135.99 146.76 47.55 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.283 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 201' ' ' GLY . . . . . . . . . . . . . . . -42.43 -35.36 1.9 Allowed Glycine 0 CA--C 1.521 0.436 0 N-CA-C 110.671 -0.971 . . . . 0.0 110.671 -179.702 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 202' ' ' ARG . . . . . . . . . . . . . 8.1 tpm_? -70.38 -47.74 59.5 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.694 -0.402 . . . . 0.0 110.72 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 3.4 m 177.52 175.91 0.42 Allowed 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 121.092 0.472 . . . . 0.0 109.739 -179.576 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 1.2 tp -102.61 121.92 54.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.531 179.023 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 70.8 t -101.2 129.87 51.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 N-CA-C 109.959 -0.385 . . . . 0.0 109.959 179.046 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 -104.71 129.45 52.91 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 45.3 m -148.82 171.01 16.96 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 110.019 -0.363 . . . . 0.0 110.019 -179.627 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . 18.6 mt -68.41 149.78 48.93 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.454 -179.356 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 9.2 t80 -52.25 -46.44 65.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.316 -179.457 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 210' ' ' ASP . . . . . 0.51 ' CG ' ' H ' ' B' ' 211' ' ' THR . 19.0 t70 -146.17 -178.71 6.28 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.791 0.329 . . . . 0.0 110.295 -179.936 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 211' ' ' THR . . . . . 0.51 ' H ' ' CG ' ' B' ' 210' ' ' ASP . 30.7 p -88.5 -16.47 32.6 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.535 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 212' ' ' HIS . . . . . . . . . . . . . 37.8 m80 -46.47 -65.44 0.55 Allowed 'General case' 0 C--O 1.235 0.312 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.868 -179.834 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 213' ' ' VAL . . . . . 0.446 HG23 ' N ' ' B' ' 214' ' ' ALA . 20.3 m -50.38 -38.42 15.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 121.016 0.436 . . . . 0.0 110.139 -179.561 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 214' ' ' ALA . . . . . 0.446 ' N ' HG23 ' B' ' 213' ' ' VAL . . . -62.21 -40.93 97.74 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.215 179.754 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 68.0 tp60 -62.19 -46.05 90.66 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.871 -179.541 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 216' ' ' LEU . . . . . . . . . . . . . 14.5 tp -59.0 -42.97 91.37 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.003 -179.138 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 88.5 mt -62.8 -40.59 97.83 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.206 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 67.1 t0 -59.37 -43.79 92.83 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.333 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 219' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -66.43 -49.8 65.54 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.438 -0.347 . . . . 0.0 110.547 179.541 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -56.3 -43.02 78.5 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.855 -0.424 . . . . 0.0 109.855 179.496 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 4.2 mm -62.68 -43.55 98.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 C-N-CA 120.39 -0.524 . . . . 0.0 110.463 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -59.09 -41.3 87.72 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.797 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 223' ' ' HIS . . . . . . . . . . . . . 58.8 t60 -65.84 -37.93 87.53 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.471 179.504 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 6.7 t -58.92 -46.99 86.62 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.389 -179.747 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -75.39 -56.69 4.46 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 121.005 0.431 . . . . 0.0 110.898 179.309 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -50.97 -34.7 30.04 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.864 -179.441 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 227' ' ' LEU . . . . . . . . . . . . . 7.1 tp -152.78 100.94 2.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.641 179.544 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 228' ' ' HIS . . . . . 0.577 ' ND1' ' N ' ' B' ' 228' ' ' HIS . 0.0 OUTLIER -93.15 -75.77 0.49 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.062 179.677 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 229' ' ' LEU . . . . . 0.521 ' H ' ' CG ' ' B' ' 228' ' ' HIS . 4.4 mm? 49.96 9.46 0.04 OUTLIER 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.409 -179.857 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 230' ' ' GLY . . . . . 0.514 ' H ' ' C ' ' B' ' 228' ' ' HIS . . . -84.0 -3.02 89.39 Favored Glycine 0 CA--C 1.524 0.603 0 N-CA-C 110.808 -0.917 . . . . 0.0 110.808 179.883 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 231' ' ' LEU . . . . . . . . . . . . . 83.9 mt -69.13 -18.11 63.92 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.842 0.353 . . . . 0.0 110.492 -179.607 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 232' ' ' SER . . . . . 0.531 ' OG ' ' N ' ' B' ' 233' ' ' ASP . 54.8 p -60.7 -69.53 0.22 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.568 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 233' ' ' ASP . . . . . 0.531 ' N ' ' OG ' ' B' ' 232' ' ' SER . 57.1 t0 40.55 64.86 0.86 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.8 179.958 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 234' ' ' ARG . . . . . . . . . . . . . 20.9 mmm180 -62.61 -42.43 99.57 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.391 -179.434 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 235' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER 39.99 77.86 0.4 Allowed Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.668 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 236' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -56.63 141.83 91.08 Favored 'Trans proline' 0 C--N 1.307 -1.645 0 C-N-CA 122.691 2.26 . . . . 0.0 112.021 -179.671 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 237' ' ' SER . . . . . . . . . . . . . 37.0 t -63.17 -43.58 97.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.644 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 238' ' ' ALA . . . . . . . . . . . . . . . 45.78 -169.2 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.523 -179.84 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.745 0 CA-C-O 118.061 -1.411 . . . . 0.0 110.9 -179.98 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.248 0 N-CA-C 109.605 -1.398 . . . . 0.0 109.605 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 80.7 m80 -93.67 122.49 36.18 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 120.886 0.374 . . . . 0.0 110.506 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -168.05 158.74 31.68 Favored Glycine 0 CA--C 1.526 0.725 0 N-CA-C 110.936 -0.866 . . . . 0.0 110.936 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 27.5 m -71.9 -22.17 21.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 121.052 0.453 . . . . 0.0 110.682 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.417 ' CD ' ' N ' ' A' ' 7' ' ' GLY . 10.1 tm-20 62.69 137.26 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.379 -179.813 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLY . . . . . 0.417 ' N ' ' CD ' ' A' ' 6' ' ' GLU . . . 78.39 18.76 75.44 Favored Glycine 0 CA--C 1.524 0.614 0 N-CA-C 110.918 -0.873 . . . . 0.0 110.918 179.933 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 52.5 ptt85 -75.52 144.5 41.94 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.808 0.337 . . . . 0.0 110.306 179.863 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -131.47 125.05 31.5 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.303 179.836 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 56.3 mtp180 -85.82 149.14 50.21 Favored Pre-proline 0 CA--C 1.533 0.318 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.628 -179.777 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -69.94 65.31 1.9 Allowed 'Trans proline' 0 N--CA 1.495 1.587 0 C-N-CA 122.591 2.194 . . . . 0.0 111.944 179.357 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 21.1 m -71.24 145.68 49.47 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.999 0.428 . . . . 0.0 110.292 179.88 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.679 ' HB1' ' CD ' ' A' ' 14' ' ' PRO . . . 55.4 179.99 0.03 OUTLIER Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.702 179.748 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.679 ' CD ' ' HB1' ' A' ' 13' ' ' ALA . 24.7 Cg_exo -62.28 163.58 19.92 Favored 'Trans proline' 0 N--CA 1.494 1.527 0 C-N-CA 122.902 2.402 . . . . 0.0 111.804 179.016 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 1.021 ' H ' HD22 ' A' ' 15' ' ' LEU . 0.4 OUTLIER -72.2 55.84 0.33 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.678 -179.876 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -96.07 -60.08 1.71 Allowed 'General case' 0 C--O 1.235 0.332 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.555 179.431 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 98.5 p -58.25 -33.48 69.41 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.459 -179.713 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 48.6 tt0 -67.19 -49.41 64.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.501 179.428 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.486 ' O ' HG23 ' A' ' 23' ' ' VAL . . . -56.81 -36.79 70.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.165 -179.78 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.426 ' HB1' ' HB3' ' B' ' 155' ' ' LEU . . . -66.31 -53.31 37.96 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.407 179.565 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.06 -44.95 94.35 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.952 -179.716 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.422 HE22 HD23 ' B' ' 227' ' ' LEU . 64.6 tt0 -58.9 -50.65 73.24 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.255 0.55 . . . . 0.0 110.339 -179.806 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.486 HG23 ' O ' ' A' ' 19' ' ' ALA . 70.9 t -62.1 -44.4 98.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.94 179.562 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.27 -43.13 82.8 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.137 179.836 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 66.2 m -57.56 -43.51 84.56 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 179.793 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 21.4 m -64.22 -49.06 73.46 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.631 -0.428 . . . . 0.0 110.685 179.207 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 85.9 mt -63.42 -22.53 66.94 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.442 -179.845 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.526 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 57.6 tt0 -75.33 -57.98 3.56 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.654 179.42 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.21 -54.54 44.55 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.932 -179.391 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.549 ' O ' ' O ' ' A' ' 31' ' ' ALA . 3.9 mm? -48.74 -30.4 5.56 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 -178.962 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.549 ' O ' ' O ' ' A' ' 30' ' ' LEU . . . -56.54 -133.95 0.0 OUTLIER 'General case' 0 C--O 1.22 -0.498 0 C-N-CA 120.366 -0.534 . . . . 0.0 110.362 179.102 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.486 ' O ' ' O ' ' A' ' 31' ' ' ALA . 17.7 p 53.85 114.76 0.01 OUTLIER Pre-proline 0 CA--C 1.543 0.679 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.867 -179.807 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_exo -48.76 -44.54 31.1 Favored 'Trans proline' 0 N--CA 1.498 1.754 0 C-N-CA 122.229 1.953 . . . . 0.0 113.026 -179.74 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 39.5 t -59.92 -45.46 92.49 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.959 -178.926 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.406 ' HB3' ' HG1' ' A' ' 32' ' ' THR . 15.7 tpp180 -63.4 -36.47 83.82 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.388 -179.954 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.451 ' CD2' ' O ' ' A' ' 30' ' ' LEU . 1.6 mm? -63.15 -54.38 38.66 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.414 -0.514 . . . . 0.0 110.763 -179.181 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.413 ' O ' ' SD ' ' A' ' 37' ' ' MET . 0.0 OUTLIER -57.18 -49.23 76.61 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.008 -0.677 . . . . 0.0 110.639 -179.396 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 36.6 mm -62.62 -42.75 97.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-O 121.193 0.521 . . . . 0.0 110.383 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 42.6 tp -62.38 -43.03 99.77 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.785 -179.911 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.405 ' OG1' ' O ' ' A' ' 37' ' ' MET . 19.7 p -60.71 -35.88 77.43 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.305 -0.407 . . . . 0.0 109.997 -179.446 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -63.46 -45.85 88.91 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.274 -0.571 . . . . 0.0 110.108 178.932 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 98.1 mt -64.94 -42.54 94.55 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.951 179.701 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.532 ' NH1' ' OD1' ' A' ' 99' ' ' ASP . 68.7 ttp85 -52.04 -17.76 1.16 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.428 -179.9 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -75.91 -76.91 0.14 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.908 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -174.45 -143.67 4.51 Favored Glycine 0 CA--C 1.532 1.131 0 C-N-CA 120.539 -0.839 . . . . 0.0 111.217 -179.509 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -50.16 133.08 34.99 Favored 'Trans proline' 0 N--CA 1.493 1.464 0 C-N-CA 122.328 2.019 . . . . 0.0 112.184 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -136.68 66.79 57.53 Favored Pre-proline 0 CA--C 1.536 0.43 0 CA-C-O 121.547 0.689 . . . . 0.0 111.207 -179.941 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -51.61 148.51 20.85 Favored 'Trans proline' 0 C--N 1.299 -2.028 0 C-N-CA 121.852 1.701 . . . . 0.0 111.343 178.185 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 44.4 t -53.32 -51.4 41.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 121.253 0.549 . . . . 0.0 110.574 -178.377 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 48.4 p -62.92 -38.53 91.33 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.529 179.336 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -63.71 -41.39 98.11 Favored 'General case' 0 CA--C 1.514 -0.404 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.933 179.287 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.703 HD13 ' C ' ' A' ' 52' ' ' LEU . 2.8 tm? -61.58 -47.69 84.33 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 119.675 -0.81 . . . . 0.0 110.11 -179.492 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.515 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -52.69 -47.23 67.38 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.006 179.632 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 45.1 tp10 -54.85 -48.09 73.33 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.516 -0.474 . . . . 0.0 110.35 179.751 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -57.31 -54.0 51.71 Favored 'General case' 0 C--O 1.232 0.138 0 C-N-CA 120.493 -0.483 . . . . 0.0 111.012 -179.589 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.413 HD12 HD11 ' A' ' 52' ' ' LEU . 96.6 mt -89.08 -75.02 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.241 179.71 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' GLY . . . . . 0.515 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 133.02 96.97 0.63 Allowed Glycine 0 CA--C 1.522 0.513 0 N-CA-C 111.391 -0.684 . . . . 0.0 111.391 179.858 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.404 ' HA ' HE21 ' A' ' 60' ' ' GLN . 78.3 mtm 58.32 77.58 0.29 Allowed 'General case' 0 C--O 1.232 0.155 0 C-N-CA 120.974 -0.29 . . . . 0.0 110.878 179.117 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -173.33 32.63 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.25 0.548 . . . . 0.0 110.083 179.733 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.666 ' H ' ' CD ' ' A' ' 60' ' ' GLN . 0.0 OUTLIER -82.72 -25.06 33.27 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.612 -179.162 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.512 ' O ' ' ND1' ' A' ' 65' ' ' HIS . 73.1 m -65.82 -42.94 90.0 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.395 -179.917 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.56 -36.8 76.67 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.506 179.754 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.41 ' O ' HD23 ' A' ' 67' ' ' LEU . 55.1 t -69.78 -52.24 33.39 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.3 0 C-N-CA 120.495 -0.482 . . . . 0.0 110.802 179.759 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 11.7 t -60.44 -44.58 95.67 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.234 -0.587 . . . . 0.0 110.51 179.691 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' HIS . . . . . 0.579 ' CG ' HH21 ' A' ' 68' ' ' ARG . 0.9 OUTLIER -57.03 -47.54 80.67 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.41 -179.844 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 81.6 mt-30 -59.51 -41.53 90.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.86 0.362 . . . . 0.0 110.836 179.723 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.529 HD13 HG21 ' A' ' 76' ' ' VAL . 3.3 mm? -61.31 -44.14 97.71 Favored 'General case' 0 CA--C 1.513 -0.457 0 C-N-CA 120.616 -0.434 . . . . 0.0 110.56 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.579 HH21 ' CG ' ' A' ' 65' ' ' HIS . 88.2 mtm180 -61.61 -40.82 96.2 Favored 'General case' 0 C--N 1.312 -1.035 0 C-N-CA 120.402 -0.519 . . . . 0.0 110.62 179.777 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.529 HG23 ' O ' ' A' ' 65' ' ' HIS . 94.8 t -58.83 -52.31 61.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 -179.463 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 9.9 mp -67.06 -31.46 71.99 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.854 0.359 . . . . 0.0 110.282 179.042 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.669 HH12 ' N ' ' A' ' 78' ' ' GLY . 9.2 tpt180 -54.65 -43.83 72.69 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.881 -179.169 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -60.8 -43.59 97.96 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.329 -0.548 . . . . 0.0 110.38 179.87 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 10.0 mt -64.91 -38.92 92.59 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.024 0.44 . . . . 0.0 110.537 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 99.29 35.91 4.57 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 110.96 -0.856 . . . . 0.0 110.96 -179.722 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 85.0 mt -99.29 -19.03 17.28 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.746 0.307 . . . . 0.0 110.889 179.818 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.529 HG21 HD13 ' A' ' 67' ' ' LEU . 15.8 m -134.55 157.8 41.45 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.247 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.173 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.455 HG12 ' N ' ' A' ' 78' ' ' GLY . 70.8 t -136.8 156.83 35.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.302 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.669 ' N ' HH12 ' A' ' 71' ' ' ARG . . . -133.29 132.74 6.64 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.856 -0.898 . . . . 0.0 110.856 179.344 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -104.86 102.7 12.22 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.891 0.377 . . . . 0.0 110.467 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.746 ' H ' ' NE ' ' A' ' 80' ' ' ARG . 0.0 OUTLIER -74.27 139.43 44.28 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.197 179.52 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -150.93 145.07 25.36 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.385 178.884 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -43.2 -32.28 1.61 Allowed Glycine 0 CA--C 1.522 0.511 0 N-CA-C 110.638 -0.985 . . . . 0.0 110.638 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 71.6 ttt180 -73.52 -46.9 45.0 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.89 -0.324 . . . . 0.0 110.783 179.619 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 4.1 m 178.09 178.66 0.35 Allowed 'General case' 0 C--O 1.234 0.274 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 -179.153 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 1.4 tp -105.36 127.47 60.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.657 178.907 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 97.9 t -102.81 118.52 49.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.414 179.043 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 87.0 m-85 -95.52 127.58 41.67 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.38 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 34.5 p -150.15 165.72 32.0 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 116.195 -0.457 . . . . 0.0 109.867 -179.038 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.752 ' N ' HD22 ' A' ' 89' ' ' LEU . 2.5 mm? -67.82 146.52 53.61 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.561 -179.093 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.473 ' C ' ' CD1' ' A' ' 90' ' ' TYR . 16.4 t80 -58.27 -50.03 75.03 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.446 -179.515 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.527 ' OD1' ' N ' ' A' ' 92' ' ' THR . 53.7 t0 -101.0 155.6 17.88 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.473 -179.644 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' THR . . . . . 0.527 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 62.8 p -92.99 -24.34 18.39 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 121.104 0.478 . . . . 0.0 110.576 179.503 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -57.47 -47.94 80.52 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.221 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.554 HG13 ' N ' ' A' ' 95' ' ' ALA . 8.0 p -55.05 -44.78 75.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.243 -0.435 . . . . 0.0 109.857 -179.936 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.554 ' N ' HG13 ' A' ' 94' ' ' VAL . . . -56.0 -41.94 75.64 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.039 179.638 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 9.4 tp-100 -61.74 -39.49 91.76 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.071 179.616 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.514 ' CD1' ' HB2' ' B' ' 220' ' ' ALA . 13.5 tp -60.36 -43.51 96.44 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.153 -0.476 . . . . 0.0 109.92 -179.597 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.418 ' O ' HG22 ' A' ' 102' ' ' ILE . 4.1 mm? -64.25 -37.18 86.57 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.302 179.251 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 99' ' ' ASP . . . . . 0.532 ' OD1' ' NH1' ' A' ' 43' ' ' ARG . 97.2 m-20 -60.65 -39.89 90.0 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.186 0.517 . . . . 0.0 110.378 179.861 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -72.78 -47.24 48.33 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.391 -0.524 . . . . 0.0 110.653 179.4 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.428 ' HB2' ' CD1' ' B' ' 216' ' ' LEU . . . -62.66 -50.94 69.21 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.042 -179.851 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.554 HG23 ' N ' ' A' ' 103' ' ' TYR . 10.7 tp -59.21 -47.13 91.34 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.412 -178.673 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 103' ' ' TYR . . . . . 0.554 ' N ' HG23 ' A' ' 102' ' ' ILE . 79.5 t80 -60.54 -39.55 88.31 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.275 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 104' ' ' HIS . . . . . 0.482 ' CE1' ' OD2' ' B' ' 210' ' ' ASP . 0.9 OUTLIER -61.19 -41.66 97.19 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.728 179.601 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 33.3 t -73.56 -38.68 65.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.808 179.645 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 0.514 ' O ' ' CD2' ' A' ' 109' ' ' HIS . 83.7 tt0 -64.78 -34.58 78.67 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.637 -179.508 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 74.6 t60 -79.27 0.81 27.2 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.66 -179.807 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.437 HD23 HE22 ' B' ' 141' ' ' GLN . 36.4 tp -80.09 82.57 6.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.003 0.43 . . . . 0.0 110.399 -179.501 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 109' ' ' HIS . . . . . 0.514 ' CD2' ' O ' ' A' ' 106' ' ' GLU . 97.0 m-70 -139.54 148.29 42.38 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.653 179.718 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.526 ' N ' HD12 ' A' ' 110' ' ' LEU . 10.7 mp -62.35 -41.86 98.93 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.369 -179.843 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 90.88 92.44 1.3 Allowed Glycine 0 CA--C 1.524 0.649 0 N-CA-C 110.796 -0.921 . . . . 0.0 110.796 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 70.2 mt -74.34 151.97 39.67 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.811 0.339 . . . . 0.0 110.373 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 11.9 p -65.38 154.44 38.38 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.254 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -92.5 107.12 18.97 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.409 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 90.9 mtm-85 -89.92 144.34 26.01 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.382 179.792 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -153.64 70.57 6.64 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.423 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -52.78 -39.9 76.01 Favored 'Trans proline' 0 C--N 1.308 -1.591 0 C-N-CA 122.747 2.298 . . . . 0.0 112.0 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 32.4 t 55.19 64.64 1.72 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.593 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -64.33 -37.21 86.68 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.514 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.717 0 CA-C-O 117.937 -1.48 . . . . 0.0 110.981 -179.987 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.372 0 N-CA-C 109.656 -1.378 . . . . 0.0 109.656 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 78.6 m80 -102.18 123.17 45.56 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.894 0.378 . . . . 0.0 110.434 -179.95 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 123' ' ' GLY . . . . . . . . . . . . . . . -168.9 159.89 33.14 Favored Glycine 0 CA--C 1.524 0.609 0 N-CA-C 110.863 -0.895 . . . . 0.0 110.863 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 26.1 m -72.12 -23.57 21.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.991 0.424 . . . . 0.0 110.767 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 125' ' ' GLU . . . . . . . . . . . . . 9.7 tm-20 64.23 136.0 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.553 -179.806 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 79.22 18.58 73.98 Favored Glycine 0 CA--C 1.525 0.667 0 N-CA-C 110.885 -0.886 . . . . 0.0 110.885 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 127' ' ' ARG . . . . . . . . . . . . . 52.3 ptt85 -75.62 145.16 41.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.706 0.289 . . . . 0.0 110.528 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 128' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -131.98 127.01 35.39 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.935 0.398 . . . . 0.0 110.322 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 129' ' ' ARG . . . . . . . . . . . . . 56.5 mtp180 -87.67 149.17 45.62 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.593 -179.778 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -70.27 64.79 2.11 Favored 'Trans proline' 0 N--CA 1.495 1.616 0 C-N-CA 122.531 2.154 . . . . 0.0 111.948 179.526 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 33.7 m -71.5 146.42 48.55 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.171 179.887 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 132' ' ' ALA . . . . . 0.666 ' HB1' ' CD ' ' B' ' 133' ' ' PRO . . . 56.3 179.43 0.03 OUTLIER Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.667 179.764 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 133' ' ' PRO . . . . . 0.666 ' CD ' ' HB1' ' B' ' 132' ' ' ALA . 24.1 Cg_exo -62.91 161.83 27.88 Favored 'Trans proline' 0 N--CA 1.492 1.405 0 C-N-CA 123.013 2.475 . . . . 0.0 111.658 178.848 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 134' ' ' LEU . . . . . 1.039 ' H ' HD22 ' B' ' 134' ' ' LEU . 0.4 OUTLIER -70.6 55.9 0.17 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.781 -179.802 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 95.1 m-20 -96.33 -59.06 1.91 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.679 -0.692 . . . . 0.0 110.384 179.407 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 90.9 p -58.81 -34.13 71.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.39 -179.633 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -67.05 -49.04 66.46 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.377 179.582 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 138' ' ' ALA . . . . . 0.503 ' O ' HG23 ' B' ' 142' ' ' VAL . . . -56.87 -36.76 70.44 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 120.845 -0.342 . . . . 0.0 110.232 -179.872 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 139' ' ' ALA . . . . . 0.405 ' HB1' ' HB3' ' A' ' 36' ' ' LEU . . . -66.22 -53.41 37.47 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.498 179.415 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -59.75 -46.02 90.43 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.907 -179.756 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 141' ' ' GLN . . . . . 0.437 HE22 HD23 ' A' ' 108' ' ' LEU . 65.2 tt0 -58.14 -51.08 71.19 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.278 0.561 . . . . 0.0 110.385 -179.777 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 142' ' ' VAL . . . . . 0.503 HG23 ' O ' ' B' ' 138' ' ' ALA . 70.8 t -61.66 -44.96 99.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.992 179.703 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -57.36 -42.6 82.34 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 74.9 m -57.36 -44.11 84.09 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 179.823 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 19.7 m -63.99 -48.52 76.09 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.639 179.437 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 80.3 mt -63.69 -22.55 66.96 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.498 -179.78 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 147' ' ' GLN . . . . . 0.536 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 58.8 tt0 -75.21 -58.43 3.28 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.679 179.374 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -59.96 -54.32 47.51 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.91 -179.308 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.551 ' O ' ' O ' ' B' ' 150' ' ' ALA . 3.9 mm? -48.65 -30.89 5.95 Favored 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 -179.076 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 150' ' ' ALA . . . . . 0.551 ' O ' ' O ' ' B' ' 149' ' ' LEU . . . -56.37 -134.47 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 120.465 -0.494 . . . . 0.0 110.52 179.175 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 151' ' ' THR . . . . . 0.493 ' O ' ' O ' ' B' ' 150' ' ' ALA . 12.3 p 53.62 115.83 0.01 OUTLIER Pre-proline 0 C--N 1.32 -0.677 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.779 -179.804 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_exo -49.07 -44.27 33.47 Favored 'Trans proline' 0 N--CA 1.497 1.701 0 C-N-CA 122.118 1.879 . . . . 0.0 112.991 -179.742 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 6.9 t -59.11 -46.21 88.9 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.94 -178.859 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 16.0 tpp180 -62.96 -36.8 84.67 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.425 -179.715 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 155' ' ' LEU . . . . . 0.464 ' O ' HG23 ' B' ' 159' ' ' THR . 1.9 mm? -62.88 -54.11 43.81 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.384 -0.526 . . . . 0.0 110.821 -179.09 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 156' ' ' MET . . . . . 0.455 ' O ' ' OG1' ' B' ' 159' ' ' THR . 0.0 OUTLIER -57.72 -49.34 76.89 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.063 -0.655 . . . . 0.0 110.614 -179.416 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 157' ' ' ILE . . . . . 0.401 HD13 ' HA ' ' B' ' 157' ' ' ILE . 39.0 mm -62.63 -42.71 97.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-O 121.218 0.533 . . . . 0.0 110.337 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 48.6 tp -62.22 -43.03 99.74 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.769 -179.787 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 159' ' ' THR . . . . . 0.464 HG23 ' O ' ' B' ' 155' ' ' LEU . 23.4 p -60.52 -37.08 80.0 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.913 -0.403 . . . . 0.0 109.913 -179.455 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 75.7 mt-30 -62.71 -46.13 89.57 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.256 -0.577 . . . . 0.0 110.037 179.142 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 161' ' ' LEU . . . . . . . . . . . . . 98.2 mt -64.79 -42.87 94.72 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 120.786 -0.365 . . . . 0.0 110.908 179.63 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 162' ' ' ARG . . . . . 0.525 ' NH1' ' OD1' ' B' ' 218' ' ' ASP . 68.4 ttp85 -51.73 -18.24 1.17 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.395 -179.799 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 61.1 t30 -75.26 -75.05 0.18 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.676 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . -178.42 -141.99 4.55 Favored Glycine 0 CA--C 1.534 1.225 0 C-N-CA 120.487 -0.863 . . . . 0.0 111.199 -179.65 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -49.25 132.77 29.22 Favored 'Trans proline' 0 N--CA 1.493 1.477 0 C-N-CA 122.149 1.899 . . . . 0.0 112.338 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -138.3 67.48 46.37 Favored Pre-proline 0 CA--C 1.536 0.416 0 CA-C-O 121.558 0.694 . . . . 0.0 111.362 -179.856 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -51.97 147.93 24.79 Favored 'Trans proline' 0 C--N 1.298 -2.082 0 C-N-CA 121.772 1.648 . . . . 0.0 111.347 178.24 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . 22.1 t -53.17 -50.39 46.46 Favored 'Isoleucine or valine' 0 C--O 1.237 0.417 0 CA-C-O 121.162 0.505 . . . . 0.0 110.556 -178.296 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 169' ' ' THR . . . . . . . . . . . . . 59.1 p -63.97 -37.8 88.73 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.477 179.274 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -63.57 -41.2 98.4 Favored 'General case' 0 CA--C 1.513 -0.455 0 CA-C-O 121.249 0.547 . . . . 0.0 109.987 179.191 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 171' ' ' LEU . . . . . 0.7 ' C ' HD13 ' B' ' 171' ' ' LEU . 2.8 tm? -61.95 -46.83 87.58 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 119.706 -0.798 . . . . 0.0 109.96 -179.628 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 172' ' ' ALA . . . . . 0.513 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -52.49 -47.85 66.31 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 120.558 -0.457 . . . . 0.0 109.955 179.441 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 44.7 tp10 -54.81 -48.5 72.7 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.425 -0.51 . . . . 0.0 110.531 179.669 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -56.32 -54.93 39.59 Favored 'General case' 0 C--O 1.232 0.157 0 C-N-CA 120.581 -0.448 . . . . 0.0 110.959 -179.352 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 96.3 mt -88.89 -73.91 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.398 179.706 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 176' ' ' GLY . . . . . 0.513 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 132.24 97.53 0.69 Allowed Glycine 0 CA--C 1.523 0.534 0 N-CA-C 111.405 -0.678 . . . . 0.0 111.405 179.824 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 78.3 mtm 58.09 78.06 0.26 Allowed 'General case' 0 CA--C 1.521 -0.148 0 C-N-CA 121.04 -0.264 . . . . 0.0 110.947 179.141 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -174.19 32.23 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.02 0.438 . . . . 0.0 110.115 179.676 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 179' ' ' GLN . . . . . 0.621 ' H ' ' CD ' ' B' ' 179' ' ' GLN . 0.0 OUTLIER -82.21 -25.68 33.98 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.514 -179.017 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 180' ' ' SER . . . . . 0.526 ' O ' ' ND1' ' B' ' 184' ' ' HIS . 34.3 m -65.49 -42.98 91.57 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.589 -179.916 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -69.0 -36.91 78.34 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.633 179.826 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 54.5 t -69.8 -51.84 36.97 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.279 0 C-N-CA 120.501 -0.48 . . . . 0.0 110.785 179.791 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 48.0 t -60.05 -44.94 94.33 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.277 -0.569 . . . . 0.0 110.583 179.606 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 184' ' ' HIS . . . . . 0.588 ' CG ' HH21 ' B' ' 187' ' ' ARG . 0.9 OUTLIER -56.92 -47.61 80.19 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.395 -179.797 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -58.42 -43.07 88.51 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.967 179.699 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 186' ' ' LEU . . . . . 0.519 HD13 HG21 ' B' ' 195' ' ' VAL . 3.3 mm? -60.53 -43.96 96.58 Favored 'General case' 0 CA--C 1.511 -0.535 0 C-N-CA 120.646 -0.421 . . . . 0.0 110.558 -179.723 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 187' ' ' ARG . . . . . 0.588 HH21 ' CG ' ' B' ' 184' ' ' HIS . 86.9 mtm180 -61.32 -40.65 94.98 Favored 'General case' 0 C--N 1.312 -1.043 0 C-N-CA 120.46 -0.496 . . . . 0.0 110.463 -180.0 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 188' ' ' VAL . . . . . 0.494 HG23 ' O ' ' B' ' 184' ' ' HIS . 97.3 t -59.15 -52.36 61.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 C-N-CA 120.352 -0.539 . . . . 0.0 109.701 -179.533 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 189' ' ' LEU . . . . . 0.437 ' N ' HD12 ' B' ' 189' ' ' LEU . 10.9 mp -67.18 -31.81 72.46 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.954 0.407 . . . . 0.0 110.341 179.078 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 190' ' ' ARG . . . . . 0.666 HH12 ' N ' ' B' ' 197' ' ' GLY . 9.6 tpt180 -54.44 -43.49 71.65 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.867 -179.137 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 82.0 m-20 -61.0 -43.59 98.67 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.329 -0.549 . . . . 0.0 110.283 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 192' ' ' LEU . . . . . . . . . . . . . 10.7 mt -64.75 -39.09 93.05 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.948 0.404 . . . . 0.0 110.359 179.815 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 99.12 35.43 4.78 Favored Glycine 0 CA--C 1.524 0.621 0 N-CA-C 111.056 -0.818 . . . . 0.0 111.056 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 17.5 mt -98.7 -18.43 18.04 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.866 0.365 . . . . 0.0 110.773 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 195' ' ' VAL . . . . . 0.519 HG21 HD13 ' B' ' 186' ' ' LEU . 14.1 m -134.39 157.75 41.6 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.268 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.003 -179.912 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 196' ' ' VAL . . . . . 0.484 HG12 ' N ' ' B' ' 197' ' ' GLY . 60.8 t -137.98 158.06 32.77 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.239 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.265 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 197' ' ' GLY . . . . . 0.666 ' N ' HH12 ' B' ' 190' ' ' ARG . . . -135.75 132.69 6.27 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 179.37 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 9.7 t0 -103.47 103.87 13.89 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.865 0.364 . . . . 0.0 110.572 179.763 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 199' ' ' ARG . . . . . 0.727 ' H ' ' NE ' ' B' ' 199' ' ' ARG . 0.0 OUTLIER -74.12 139.8 44.8 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.955 179.46 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 200' ' ' ALA . . . . . . . . . . . . . . . -151.09 144.46 24.84 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 120.566 -0.454 . . . . 0.0 110.338 178.943 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 201' ' ' GLY . . . . . . . . . . . . . . . -42.84 -33.22 1.58 Allowed Glycine 0 CA--C 1.524 0.597 0 N-CA-C 110.589 -1.004 . . . . 0.0 110.589 -179.805 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 202' ' ' ARG . . . . . . . . . . . . . 72.8 ttt180 -72.7 -46.28 54.5 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.696 179.76 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 3.5 m 177.6 178.76 0.3 Allowed 'General case' 0 N--CA 1.455 -0.222 0 CA-C-O 121.06 0.457 . . . . 0.0 109.854 -179.077 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 1.4 tp -105.97 126.75 61.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.58 179.094 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 89.2 t -102.14 118.5 49.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.41 178.999 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 89.9 m-85 -94.98 127.74 41.26 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.384 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 30.4 p -150.33 165.53 32.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.879 -179.042 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 208' ' ' LEU . . . . . 0.739 HD22 ' N ' ' B' ' 208' ' ' LEU . 2.6 mm? -67.3 147.84 52.45 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.898 -179.186 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 209' ' ' TYR . . . . . 0.469 ' C ' ' CD1' ' B' ' 209' ' ' TYR . 17.0 t80 -59.05 -49.22 78.73 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.405 -179.662 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 210' ' ' ASP . . . . . 0.529 ' OD1' ' N ' ' B' ' 211' ' ' THR . 53.5 t0 -102.63 155.7 18.12 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.602 -179.596 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 211' ' ' THR . . . . . 0.529 ' N ' ' OD1' ' B' ' 210' ' ' ASP . 23.8 p -92.78 -24.24 18.61 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.005 0.431 . . . . 0.0 110.348 179.629 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 212' ' ' HIS . . . . . . . . . . . . . 88.3 m-70 -57.15 -48.14 79.43 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.204 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 213' ' ' VAL . . . . . 0.557 HG13 ' N ' ' B' ' 214' ' ' ALA . 9.6 p -55.35 -44.93 77.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 N-CA-C 109.862 -0.422 . . . . 0.0 109.862 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 214' ' ' ALA . . . . . 0.557 ' N ' HG13 ' B' ' 213' ' ' VAL . . . -54.98 -42.86 72.96 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.186 179.583 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 9.6 tp-100 -61.68 -39.67 92.26 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.093 179.545 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 216' ' ' LEU . . . . . 0.428 ' CD1' ' HB2' ' A' ' 101' ' ' ALA . 15.2 tp -59.89 -43.36 94.85 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.585 -0.446 . . . . 0.0 109.883 -179.489 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 217' ' ' LEU . . . . . 0.444 ' O ' HG22 ' B' ' 221' ' ' ILE . 4.2 mm? -64.32 -37.73 88.53 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.408 179.193 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 218' ' ' ASP . . . . . 0.525 ' OD1' ' NH1' ' B' ' 162' ' ' ARG . 98.6 m-20 -60.44 -39.78 88.75 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.122 0.487 . . . . 0.0 110.408 -179.735 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 219' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -72.84 -47.43 46.31 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.496 -0.482 . . . . 0.0 110.696 179.366 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 220' ' ' ALA . . . . . 0.514 ' HB2' ' CD1' ' A' ' 97' ' ' LEU . . . -62.85 -51.11 68.3 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.888 0.375 . . . . 0.0 111.19 -179.847 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 221' ' ' ILE . . . . . 0.558 HG23 ' N ' ' B' ' 222' ' ' TYR . 10.9 tp -58.65 -47.13 89.69 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.363 -178.931 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 222' ' ' TYR . . . . . 0.558 ' N ' HG23 ' B' ' 221' ' ' ILE . 89.1 t80 -60.24 -39.7 87.64 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.258 179.863 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 223' ' ' HIS . . . . . 0.514 ' CE1' ' OD2' ' A' ' 91' ' ' ASP . 0.9 OUTLIER -60.89 -41.91 96.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.979 179.659 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 6.2 t -73.58 -38.34 65.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.923 0.392 . . . . 0.0 110.889 179.589 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 225' ' ' GLU . . . . . 0.481 ' O ' ' CD2' ' B' ' 228' ' ' HIS . 80.1 tt0 -64.82 -35.14 80.15 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.681 -179.504 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 76.6 t60 -79.2 1.37 24.87 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.649 -179.839 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 227' ' ' LEU . . . . . 0.422 HD23 HE22 ' A' ' 22' ' ' GLN . 36.1 tp -80.43 82.16 6.53 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.466 -179.386 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 228' ' ' HIS . . . . . 0.481 ' CD2' ' O ' ' B' ' 225' ' ' GLU . 95.9 m-70 -138.39 149.52 45.62 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.55 179.754 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 229' ' ' LEU . . . . . 0.613 ' N ' HD12 ' B' ' 229' ' ' LEU . 9.5 mp -63.15 -41.93 99.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.262 -179.689 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . 92.25 93.31 1.41 Allowed Glycine 0 CA--C 1.526 0.738 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 -179.906 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 231' ' ' LEU . . . . . . . . . . . . . 69.1 mt -76.2 148.31 37.8 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.765 0.317 . . . . 0.0 110.539 -179.906 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 232' ' ' SER . . . . . . . . . . . . . 91.4 p -62.83 154.17 30.78 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.34 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 233' ' ' ASP . . . . . . . . . . . . . 97.1 m-20 -93.01 108.03 19.69 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.263 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 234' ' ' ARG . . . . . . . . . . . . . 89.7 mtm-85 -90.58 143.21 26.96 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.398 179.835 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 235' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -151.54 70.57 8.16 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.445 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 236' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -53.21 -39.09 81.75 Favored 'Trans proline' 0 C--N 1.307 -1.652 0 C-N-CA 122.84 2.36 . . . . 0.0 112.014 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 237' ' ' SER . . . . . . . . . . . . . 37.6 t 54.23 65.77 1.42 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.399 -179.914 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 238' ' ' ALA . . . . . . . . . . . . . . . -64.44 -36.71 85.07 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.567 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.746 0 CA-C-O 117.963 -1.465 . . . . 0.0 110.933 179.991 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.25 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 50.13 87.65 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.833 0.349 . . . . 0.0 110.701 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 81.9 -3.1 81.47 Favored Glycine 0 CA--C 1.523 0.538 0 N-CA-C 111.018 -0.833 . . . . 0.0 111.018 179.849 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 92.1 t -127.75 130.85 70.27 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 CA-C-O 120.891 0.376 . . . . 0.0 110.407 179.857 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 44.58 26.47 0.18 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.568 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -61.0 -40.84 99.06 Favored Glycine 0 CA--C 1.522 0.512 0 N-CA-C 110.926 -0.869 . . . . 0.0 110.926 -179.755 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 61.6 ttt85 -117.43 104.83 11.49 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 179.758 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 59.9 t-20 -96.93 112.69 24.33 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.523 179.964 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 61.4 mtp180 -89.27 147.78 39.11 Favored Pre-proline 0 CA--C 1.536 0.432 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.504 -179.585 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -44.05 134.6 8.35 Favored 'Trans proline' 0 N--CA 1.492 1.387 0 C-N-CA 122.276 1.984 . . . . 0.0 112.28 179.268 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.457 ' O ' ' O ' ' A' ' 13' ' ' ALA . 48.1 t -152.45 142.66 22.4 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.441 179.923 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.457 ' O ' ' O ' ' A' ' 12' ' ' SER . . . 56.84 150.81 0.06 OUTLIER Pre-proline 0 CA--C 1.542 0.663 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.858 179.926 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.439 ' C ' ' H ' ' A' ' 16' ' ' ASP . 61.5 Cg_endo -73.13 153.15 51.58 Favored 'Trans proline' 0 C--N 1.31 -1.455 0 C-N-CA 122.504 2.136 . . . . 0.0 112.018 179.0 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.649 ' N ' HD12 ' A' ' 15' ' ' LEU . 5.7 mp -78.02 32.99 0.18 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.432 179.74 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.439 ' H ' ' C ' ' A' ' 14' ' ' PRO . 97.8 m-20 -96.56 -59.74 1.75 Allowed 'General case' 0 C--O 1.238 0.461 0 CA-C-O 121.321 0.581 . . . . 0.0 111.022 179.012 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 87.8 p -57.66 -33.11 67.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.271 -179.646 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 94.1 mm-40 -67.14 -50.73 60.25 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.282 179.752 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.471 ' O ' HG23 ' A' ' 23' ' ' VAL . . . -56.05 -34.83 66.26 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.031 -179.656 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.66 -53.09 24.5 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 121.275 0.56 . . . . 0.0 110.422 179.378 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.96 -46.18 90.25 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.246 179.845 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.477 ' N ' ' OE1' ' A' ' 22' ' ' GLN . 0.9 OUTLIER -60.09 -52.26 66.13 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.037 0.446 . . . . 0.0 110.606 -179.574 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.471 HG23 ' O ' ' A' ' 19' ' ' ALA . 77.5 t -62.3 -46.91 95.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 C-N-CA 120.457 -0.497 . . . . 0.0 110.06 -179.934 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -50.47 -47.91 56.87 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-O 120.99 0.424 . . . . 0.0 110.224 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.5 t -59.38 -42.84 92.58 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.342 179.812 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 95.0 m -61.42 -51.2 69.73 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.766 -179.68 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.45 ' N ' ' CD1' ' A' ' 27' ' ' LEU . 7.6 mp -67.17 -22.14 65.77 Favored 'General case' 0 CA--C 1.523 -0.075 0 CA-C-O 120.763 0.316 . . . . 0.0 110.645 179.759 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.498 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 62.3 tt0 -71.26 -62.48 1.39 Allowed 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.526 179.112 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.414 ' HB1' ' NH1' ' A' ' 35' ' ' ARG . . . -57.25 -53.68 55.42 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 120.753 -0.379 . . . . 0.0 110.591 -179.346 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.493 ' O ' ' O ' ' A' ' 31' ' ' ALA . 85.7 mt -46.54 -31.4 2.75 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.417 -178.985 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.498 ' HB3' ' O ' ' A' ' 28' ' ' GLN . . . -57.06 -127.87 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.423 0 O-C-N 123.667 0.604 . . . . 0.0 110.339 179.522 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.43 ' O ' ' O ' ' A' ' 31' ' ' ALA . 0.5 OUTLIER 53.88 108.26 0.02 OUTLIER Pre-proline 0 CA--C 1.544 0.738 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.592 179.973 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -48.48 -56.01 3.54 Favored 'Trans proline' 0 N--CA 1.494 1.535 0 C-N-CA 122.061 1.841 . . . . 0.0 113.282 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 79.9 p -59.88 -46.19 90.1 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.097 -178.953 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.418 ' HB3' ' HG1' ' A' ' 32' ' ' THR . 35.5 ttm180 -62.78 -43.4 98.91 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.426 -179.786 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.56 HD23 ' O ' ' A' ' 36' ' ' LEU . 1.9 tt -61.46 -53.37 57.4 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.675 -178.785 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 11.0 tpt -51.55 -48.74 62.97 Favored 'General case' 0 C--O 1.242 0.66 0 C-N-CA 120.338 -0.545 . . . . 0.0 110.419 -179.788 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 96.6 mt -60.8 -46.48 96.07 Favored 'Isoleucine or valine' 0 C--O 1.243 0.72 0 CA-C-O 121.545 0.688 . . . . 0.0 110.375 -179.264 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 72.6 mt -59.98 -41.4 91.92 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.14 179.813 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 13.8 m -55.48 -43.08 75.21 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.119 179.698 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 29.1 mm100 -61.52 -44.21 97.47 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.401 -0.52 . . . . 0.0 110.72 179.676 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.569 HD11 ' O ' ' A' ' 87' ' ' TYR . 13.7 tp -68.57 -44.3 74.75 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.335 -0.546 . . . . 0.0 111.323 180.0 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 89.3 mtm-85 -49.18 -17.14 0.2 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.322 -178.879 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.417 ' N ' ' C ' ' A' ' 42' ' ' LEU . 60.9 t-20 -147.06 65.22 1.16 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.086 179.795 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 159.29 82.01 0.04 OUTLIER Glycine 0 CA--C 1.529 0.937 0 N-CA-C 111.121 -0.792 . . . . 0.0 111.121 -179.866 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_exo -69.77 113.34 3.34 Favored 'Trans proline' 0 N--CA 1.497 1.711 0 C-N-CA 123.172 2.581 . . . . 0.0 111.061 178.786 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.554 HD12 ' O ' ' A' ' 47' ' ' LEU . 0.3 OUTLIER -167.15 158.61 10.48 Favored Pre-proline 0 C--N 1.324 -0.531 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.544 -179.171 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -62.71 -171.59 0.11 Allowed 'Trans proline' 0 N--CA 1.497 1.68 0 C-N-CA 122.667 2.245 . . . . 0.0 112.052 178.756 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.548 ' O ' ' N ' ' A' ' 52' ' ' LEU . 46.4 t -75.69 -62.99 1.13 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.353 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.509 -179.918 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.431 ' C ' ' O ' ' A' ' 49' ' ' VAL . 14.5 m -34.7 -49.32 0.41 Allowed 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 121.184 0.516 . . . . 0.0 110.597 -179.268 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -61.79 -44.32 97.12 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.275 178.983 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.61 HD23 ' O ' ' A' ' 52' ' ' LEU . 1.3 tt -62.47 -38.67 90.73 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.773 -179.919 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.12 -42.02 93.86 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.047 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -62.66 -43.96 97.48 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.134 179.791 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.99 -54.95 22.4 Favored 'General case' 0 C--N 1.332 -0.159 0 C-N-CA 120.584 -0.446 . . . . 0.0 110.951 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.682 HG23 ' O ' ' A' ' 56' ' ' ILE . 6.8 tt -176.75 86.45 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.456 -0.133 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.761 -179.863 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' GLY . . . . . 0.508 ' O ' ' N ' ' A' ' 59' ' ' GLU . . . -157.6 -49.79 0.01 OUTLIER Glycine 0 CA--C 1.523 0.544 0 N-CA-C 110.425 -1.07 . . . . 0.0 110.425 178.608 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 99.6 mtp 43.0 17.86 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.747 0.308 . . . . 0.0 110.745 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.508 ' N ' ' O ' ' A' ' 57' ' ' GLY . 95.8 mt-10 -148.31 68.61 1.09 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.152 0.501 . . . . 0.0 109.725 -179.374 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 8.7 mt-30 -58.46 -36.32 73.52 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.798 -179.397 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 37.7 t -62.15 -45.35 93.81 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.777 -179.749 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -61.89 -36.22 80.64 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.293 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 94.0 t -65.41 -50.7 71.21 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 C-N-CA 120.657 -0.417 . . . . 0.0 110.587 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.4 t -57.74 -45.98 85.1 Favored 'General case' 0 C--N 1.332 -0.165 0 C-N-CA 120.722 -0.391 . . . . 0.0 110.331 -179.275 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 48.8 m170 -61.65 -48.0 82.81 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-O 121.191 0.52 . . . . 0.0 110.618 179.803 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 15.6 tt0 -61.83 -40.11 94.14 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.217 -179.903 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.6 tp -62.39 -43.27 99.21 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.232 -179.472 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -60.7 -42.92 98.13 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 120.827 -0.349 . . . . 0.0 110.732 -179.876 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 95.8 t -64.88 -54.19 32.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 C-N-CA 119.898 -0.721 . . . . 0.0 110.674 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 96.6 mt -59.48 -40.34 86.67 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 -178.922 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 62.2 ttp180 -57.97 -41.42 82.91 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.218 179.703 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -58.04 -48.62 79.54 Favored 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 120.596 -0.441 . . . . 0.0 110.539 -179.585 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.536 HD22 ' N ' ' A' ' 73' ' ' LEU . 4.0 mm? -66.36 -41.08 89.98 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.63 179.544 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' GLY . . . . . 0.433 ' C ' HD12 ' A' ' 75' ' ' LEU . . . 107.42 38.83 2.03 Favored Glycine 0 CA--C 1.525 0.671 0 N-CA-C 111.089 -0.805 . . . . 0.0 111.089 -179.812 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.496 ' N ' HD12 ' A' ' 75' ' ' LEU . 9.9 mp -98.86 -13.22 20.16 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 110.446 -0.205 . . . . 0.0 110.446 179.43 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 23.1 m -136.33 155.53 34.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.404 HG23 ' HA ' ' A' ' 90' ' ' TYR . 24.8 t -139.84 150.23 22.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.663 179.847 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -110.67 158.11 14.59 Favored Glycine 0 CA--C 1.523 0.552 0 N-CA-C 110.153 -1.179 . . . . 0.0 110.153 178.905 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -131.47 146.86 52.44 Favored 'General case' 0 CA--C 1.515 -0.378 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 -179.922 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 62.3 ttp180 -111.5 137.97 48.63 Favored 'General case' 0 N--CA 1.468 0.428 0 O-C-N 123.513 0.508 . . . . 0.0 110.411 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -147.85 128.78 14.44 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.409 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 48.13 -99.1 0.02 OUTLIER Glycine 0 CA--C 1.523 0.534 0 N-CA-C 110.776 -0.93 . . . . 0.0 110.776 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 66.5 ttt-85 -132.29 45.43 2.76 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.066 0.46 . . . . 0.0 110.145 -179.801 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 88.8 p -163.53 164.12 24.4 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 121.009 0.433 . . . . 0.0 109.938 -179.855 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.622 HD11 ' CZ ' ' A' ' 87' ' ' TYR . 1.0 OUTLIER -140.01 156.93 25.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.549 179.603 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.578 ' N ' HD12 ' A' ' 85' ' ' ILE . 15.5 m -133.92 156.64 41.33 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.394 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.324 179.2 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.622 ' CZ ' HD11 ' A' ' 85' ' ' ILE . 77.5 m-85 -108.03 136.56 47.52 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.279 -179.729 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 47.5 t -150.63 170.03 20.16 Favored 'General case' 0 CA--C 1.514 -0.439 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.428 ' N ' HD22 ' A' ' 89' ' ' LEU . 4.4 mm? -61.66 153.26 28.57 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.737 179.259 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.404 ' HA ' HG23 ' A' ' 77' ' ' VAL . 65.5 t80 -50.51 -45.83 56.83 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.485 179.953 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.498 ' OD2' ' CG ' ' A' ' 93' ' ' HIS . 28.3 t70 -156.88 168.41 27.55 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.937 -0.305 . . . . 0.0 110.507 179.88 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' THR . . . . . 0.538 ' O ' ' HB3' ' A' ' 95' ' ' ALA . 64.1 p -68.88 -32.28 71.82 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.838 -179.999 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 93' ' ' HIS . . . . . 0.498 ' CG ' ' OD2' ' A' ' 91' ' ' ASP . 27.3 m170 -39.46 -67.79 0.2 Allowed 'General case' 0 C--O 1.24 0.56 0 CA-C-O 121.34 0.591 . . . . 0.0 110.716 -179.9 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 57.7 t -45.73 -40.42 3.22 Favored 'Isoleucine or valine' 0 C--O 1.236 0.395 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.32 179.744 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.538 ' HB3' ' O ' ' A' ' 92' ' ' THR . . . -61.49 -38.09 86.04 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.31 -179.989 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -60.74 -44.99 95.98 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.303 0.573 . . . . 0.0 110.028 -179.653 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.518 ' N ' ' CD1' ' A' ' 97' ' ' LEU . 6.4 mp -61.51 -46.32 90.48 Favored 'General case' 0 C--O 1.24 0.592 0 CA-C-O 121.522 0.677 . . . . 0.0 110.193 -179.467 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 17.7 mt -66.61 -33.86 76.59 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.259 179.494 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 91.7 m-20 -59.87 -42.48 93.78 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 -179.597 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -65.45 -48.68 71.85 Favored 'General case' 0 N--CA 1.462 0.149 0 N-CA-C 109.819 -0.438 . . . . 0.0 109.819 179.458 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.26 -44.82 96.63 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.946 179.439 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 5.3 mm -63.63 -46.17 95.56 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.932 -179.824 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 90.2 t80 -63.78 -50.78 67.65 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 120.711 -0.396 . . . . 0.0 110.643 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 56.7 t-80 -59.93 -33.9 72.51 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.677 -179.617 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 7.5 t -76.06 -50.37 14.93 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.866 0.365 . . . . 0.0 111.323 179.898 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -64.81 -22.03 66.9 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.534 -179.733 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 34.5 t60 -60.22 -73.31 0.09 Allowed 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 120.551 -0.46 . . . . 0.0 110.524 -179.048 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 45.1 mt -79.87 -45.25 18.98 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.018 0.437 . . . . 0.0 110.447 179.779 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 51.2 t-80 43.93 51.62 6.89 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.757 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 70.6 mt -63.33 -42.41 98.96 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.702 -179.827 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 88.32 -106.32 3.23 Favored Glycine 0 CA--C 1.524 0.628 0 N-CA-C 111.041 -0.824 . . . . 0.0 111.041 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.589 HD12 ' N ' ' A' ' 112' ' ' LEU . 10.0 mp 43.94 60.22 2.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.851 0.358 . . . . 0.0 110.514 -179.754 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 69.0 m -60.79 -41.29 95.32 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.346 179.841 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 52.11 28.05 5.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.455 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 -142.92 11.93 1.83 Allowed 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.711 -179.886 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' HIS . . . . . 0.625 ' N ' ' CD ' ' A' ' 117' ' ' PRO . 0.8 OUTLIER -64.84 -42.38 62.73 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.355 179.787 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 117' ' ' PRO . . . . . 0.625 ' CD ' ' N ' ' A' ' 116' ' ' HIS . 36.9 Cg_exo -59.9 143.01 99.65 Favored 'Trans proline' 0 C--N 1.309 -1.544 0 C-N-CA 122.499 2.133 . . . . 0.0 111.86 -179.241 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 41.6 m -61.09 -41.54 96.86 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.508 179.635 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . 48.28 94.54 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.543 -179.82 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.772 0 CA-C-O 118.006 -1.441 . . . . 0.0 110.982 -179.914 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.29 0 N-CA-C 109.489 -1.444 . . . . 0.0 109.489 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 47.57 86.55 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.883 0.373 . . . . 0.0 110.713 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 123' ' ' GLY . . . . . . . . . . . . . . . 82.32 -5.68 71.62 Favored Glycine 0 CA--C 1.522 0.471 0 N-CA-C 111.0 -0.84 . . . . 0.0 111.0 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 76.5 t -125.3 130.33 72.95 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.375 0 CA-C-O 120.792 0.33 . . . . 0.0 110.215 179.917 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 125' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 45.24 26.87 0.29 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.491 179.832 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -62.01 -41.22 99.66 Favored Glycine 0 CA--C 1.523 0.562 0 N-CA-C 110.987 -0.845 . . . . 0.0 110.987 -179.813 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 127' ' ' ARG . . . . . . . . . . . . . 61.6 ttt85 -117.1 106.64 13.58 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.855 0.36 . . . . 0.0 110.058 179.762 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 128' ' ' ASN . . . . . . . . . . . . . 61.3 t-20 -100.01 114.65 28.1 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.465 -179.928 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 129' ' ' ARG . . . . . . . . . . . . . 60.6 mtp180 -92.07 147.22 34.31 Favored Pre-proline 0 CA--C 1.536 0.416 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.252 -179.561 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -44.42 135.99 8.8 Favored 'Trans proline' 0 N--CA 1.491 1.35 0 C-N-CA 122.346 2.031 . . . . 0.0 112.532 179.491 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 131' ' ' SER . . . . . 0.449 ' O ' ' O ' ' B' ' 132' ' ' ALA . 46.7 t -155.62 142.3 18.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.406 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 132' ' ' ALA . . . . . 0.449 ' O ' ' O ' ' B' ' 131' ' ' SER . . . 56.69 150.16 0.06 OUTLIER Pre-proline 0 CA--C 1.543 0.706 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.124 179.936 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 133' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -73.46 149.1 43.94 Favored 'Trans proline' 0 C--N 1.311 -1.422 0 C-N-CA 122.418 2.079 . . . . 0.0 112.101 179.001 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 134' ' ' LEU . . . . . 0.666 ' N ' HD12 ' B' ' 134' ' ' LEU . 6.5 mp -63.69 -39.02 93.29 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.478 179.675 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 135' ' ' ASP . . . . . 0.422 ' C ' ' O ' ' B' ' 134' ' ' LEU . 97.9 m-20 -32.49 -55.38 0.34 Allowed 'General case' 0 N--CA 1.469 0.477 0 O-C-N 123.621 0.576 . . . . 0.0 111.056 -178.715 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 77.5 p -56.77 -45.66 81.96 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.176 179.237 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 137' ' ' GLN . . . . . 0.522 ' N ' ' O ' ' B' ' 134' ' ' LEU . 95.5 mm-40 -62.56 -45.73 91.57 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.306 -179.965 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 138' ' ' ALA . . . . . 0.523 ' O ' HG23 ' B' ' 142' ' ' VAL . . . -56.64 -34.29 67.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.277 -179.886 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.7 -53.26 23.22 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-O 121.045 0.45 . . . . 0.0 110.419 179.394 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -60.17 -46.65 88.96 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 120.604 -0.438 . . . . 0.0 111.356 179.924 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 141' ' ' GLN . . . . . 0.511 ' N ' ' OE1' ' B' ' 141' ' ' GLN . 0.8 OUTLIER -59.29 -52.57 65.07 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.114 0.483 . . . . 0.0 110.767 -179.439 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 142' ' ' VAL . . . . . 0.523 HG23 ' O ' ' B' ' 138' ' ' ALA . 96.7 t -62.05 -47.09 94.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 C-N-CA 120.395 -0.522 . . . . 0.0 110.113 -179.8 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -50.85 -47.26 60.32 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 120.931 0.396 . . . . 0.0 110.322 -179.649 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 14.4 t -59.28 -42.33 90.99 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.019 179.78 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 96.4 m -62.57 -51.61 66.66 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.406 -0.518 . . . . 0.0 110.806 -179.95 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 146' ' ' LEU . . . . . 0.423 ' N ' ' CD1' ' B' ' 146' ' ' LEU . 7.8 mp -66.24 -22.62 66.33 Favored 'General case' 0 CA--C 1.523 -0.096 0 CA-C-O 120.807 0.337 . . . . 0.0 110.653 179.602 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 147' ' ' GLN . . . . . 0.495 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 62.4 tt0 -70.89 -63.28 1.13 Allowed 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.593 179.262 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -56.85 -53.28 59.71 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 120.691 -0.404 . . . . 0.0 110.924 -179.297 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.494 ' O ' ' O ' ' B' ' 150' ' ' ALA . 88.9 mt -46.5 -31.0 2.47 Favored 'General case' 0 CA--C 1.511 -0.548 0 C-N-CA 120.956 -0.298 . . . . 0.0 110.503 -179.106 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 150' ' ' ALA . . . . . 0.495 ' HB3' ' O ' ' B' ' 147' ' ' GLN . . . -57.57 -128.58 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.454 0 O-C-N 123.54 0.525 . . . . 0.0 110.517 179.511 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 151' ' ' THR . . . . . 0.436 ' O ' ' O ' ' B' ' 150' ' ' ALA . 0.6 OUTLIER 53.81 107.39 0.02 OUTLIER Pre-proline 0 CA--C 1.543 0.677 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.554 179.946 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -47.9 -59.25 1.32 Allowed 'Trans proline' 0 N--CA 1.494 1.533 0 C-N-CA 122.122 1.881 . . . . 0.0 113.338 -179.811 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 78.2 p -56.6 -46.6 80.78 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.055 -178.76 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 154' ' ' ARG . . . . . 0.401 ' HB3' ' HG1' ' B' ' 151' ' ' THR . 36.1 ttm180 -62.4 -43.33 99.07 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.451 179.795 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 155' ' ' LEU . . . . . 0.53 HD23 ' O ' ' B' ' 155' ' ' LEU . 1.8 tt -61.05 -53.88 51.75 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 120.468 -0.493 . . . . 0.0 110.582 -178.733 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 11.0 tpt -51.16 -48.86 61.78 Favored 'General case' 0 C--O 1.24 0.584 0 C-N-CA 120.178 -0.609 . . . . 0.0 110.425 -179.741 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 96.3 mt -59.94 -47.33 92.07 Favored 'Isoleucine or valine' 0 C--O 1.244 0.785 0 CA-C-O 121.715 0.769 . . . . 0.0 110.29 -179.417 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 75.3 mt -59.11 -41.89 89.24 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.053 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 13.6 m -54.77 -43.53 72.88 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.354 179.718 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 28.6 mm100 -60.72 -44.68 96.32 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.393 -0.523 . . . . 0.0 110.574 179.725 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 161' ' ' LEU . . . . . 0.589 HD11 ' O ' ' B' ' 206' ' ' TYR . 13.4 tp -68.43 -43.73 76.47 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.351 -0.54 . . . . 0.0 111.401 179.887 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 162' ' ' ARG . . . . . . . . . . . . . 88.5 mtm-85 -50.04 -19.63 0.77 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.355 -178.8 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 55.3 t-20 -142.89 64.81 1.35 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.057 179.836 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . 156.81 88.72 0.07 OUTLIER Glycine 0 CA--C 1.539 1.579 0 N-CA-C 110.978 -0.849 . . . . 0.0 110.978 179.886 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -77.87 113.98 3.55 Favored 'Trans proline' 0 N--CA 1.496 1.639 0 C-N-CA 122.518 2.145 . . . . 0.0 110.966 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 166' ' ' LEU . . . . . 0.547 ' O ' HD12 ' B' ' 166' ' ' LEU . 0.3 OUTLIER -164.98 158.29 14.29 Favored Pre-proline 0 C--N 1.325 -0.462 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.711 -178.663 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_endo -61.08 -172.02 0.08 OUTLIER 'Trans proline' 0 N--CA 1.496 1.621 0 C-N-CA 122.871 2.381 . . . . 0.0 112.1 178.908 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 168' ' ' VAL . . . . . 0.554 ' O ' ' N ' ' B' ' 171' ' ' LEU . 47.1 t -75.39 -62.85 1.18 Allowed 'Isoleucine or valine' 0 C--O 1.224 -0.282 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.504 -179.786 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 169' ' ' THR . . . . . 0.423 ' C ' ' O ' ' B' ' 168' ' ' VAL . 17.3 m -34.58 -48.72 0.38 Allowed 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 121.126 0.488 . . . . 0.0 110.624 -179.157 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -62.44 -44.14 97.14 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.285 178.988 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 171' ' ' LEU . . . . . 0.602 HD23 ' O ' ' B' ' 171' ' ' LEU . 1.2 tt -62.37 -39.32 92.79 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.226 0.536 . . . . 0.0 109.812 -179.819 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 172' ' ' ALA . . . . . . . . . . . . . . . -60.7 -42.29 96.91 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.328 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -62.25 -43.02 99.78 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.112 179.777 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -66.76 -54.54 21.78 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.587 -0.445 . . . . 0.0 110.931 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 175' ' ' ILE . . . . . 0.687 ' O ' HG23 ' B' ' 175' ' ' ILE . 8.8 tt -176.97 86.97 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.456 -0.147 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.719 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 176' ' ' GLY . . . . . 0.533 ' O ' ' N ' ' B' ' 178' ' ' GLU . . . -157.56 -49.0 0.01 OUTLIER Glycine 0 CA--C 1.522 0.471 0 N-CA-C 110.528 -1.029 . . . . 0.0 110.528 178.611 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 97.6 mtp 41.81 19.42 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.139 0 CA-C-O 120.787 0.327 . . . . 0.0 110.755 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 178' ' ' GLU . . . . . 0.533 ' N ' ' O ' ' B' ' 176' ' ' GLY . 94.3 mt-10 -150.06 67.05 0.97 Allowed 'General case' 0 CA--C 1.52 -0.195 0 CA-C-O 121.049 0.452 . . . . 0.0 109.989 -179.342 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 9.1 mt-30 -57.09 -37.28 71.67 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.863 -179.64 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 44.5 t -61.97 -45.95 91.42 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.805 -179.76 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -61.62 -36.4 80.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.404 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 95.5 t -64.91 -50.71 73.79 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 C-N-CA 120.593 -0.443 . . . . 0.0 110.656 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 12.0 t -58.31 -45.23 88.43 Favored 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.086 -178.864 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 46.6 m170 -61.67 -47.67 84.29 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-O 121.209 0.528 . . . . 0.0 110.656 179.591 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 16.5 tt0 -62.1 -40.21 95.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.234 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 186' ' ' LEU . . . . . 0.418 HD21 ' CD1' ' B' ' 206' ' ' TYR . 6.9 tp -62.63 -43.2 99.4 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.404 -179.658 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -60.2 -42.8 95.86 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.754 -0.379 . . . . 0.0 110.315 179.912 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 73.9 t -64.69 -54.39 30.75 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.211 0 C-N-CA 119.898 -0.721 . . . . 0.0 110.558 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 189' ' ' LEU . . . . . 0.402 HD23 ' HA ' ' B' ' 189' ' ' LEU . 98.5 mt -59.67 -40.95 89.49 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 -178.704 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 62.1 ttp180 -56.95 -42.25 79.74 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.29 179.775 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 40.6 t30 -57.03 -50.79 71.66 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.586 -0.446 . . . . 0.0 110.487 -179.671 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 192' ' ' LEU . . . . . 0.532 ' N ' HD22 ' B' ' 192' ' ' LEU . 3.9 mm? -64.45 -41.69 96.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.646 179.819 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 193' ' ' GLY . . . . . 0.419 ' C ' HD12 ' B' ' 194' ' ' LEU . . . 107.89 38.01 2.09 Favored Glycine 0 CA--C 1.524 0.613 0 N-CA-C 111.13 -0.788 . . . . 0.0 111.13 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 194' ' ' LEU . . . . . 0.506 ' N ' HD12 ' B' ' 194' ' ' LEU . 9.8 mp -97.49 -12.97 22.01 Favored 'General case' 0 N--CA 1.466 0.371 0 O-C-N 122.766 -0.255 . . . . 0.0 110.394 179.355 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 26.2 m -137.21 156.23 33.43 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.384 0 N-CA-C 109.981 -0.378 . . . . 0.0 109.981 -179.878 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 196' ' ' VAL . . . . . . . . . . . . . 29.9 t -141.42 152.55 19.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.451 179.583 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 197' ' ' GLY . . . . . . . . . . . . . . . -112.1 160.65 13.06 Favored Glycine 0 CA--C 1.522 0.509 0 N-CA-C 110.379 -1.088 . . . . 0.0 110.379 179.365 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 95.3 m-20 -132.13 145.55 51.46 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 62.2 ttp180 -110.16 133.84 52.81 Favored 'General case' 0 N--CA 1.466 0.367 0 O-C-N 123.4 0.438 . . . . 0.0 110.431 179.924 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 200' ' ' ALA . . . . . . . . . . . . . . . -145.45 132.53 20.36 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.389 179.909 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 201' ' ' GLY . . . . . . . . . . . . . . . 47.15 -104.45 0.08 OUTLIER Glycine 0 CA--C 1.522 0.528 0 N-CA-C 110.511 -1.036 . . . . 0.0 110.511 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 202' ' ' ARG . . . . . . . . . . . . . 68.2 ttt-85 -128.61 47.17 2.48 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 121.093 0.473 . . . . 0.0 109.967 179.946 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 85.8 p -164.92 166.87 19.15 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 121.036 0.445 . . . . 0.0 109.982 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 204' ' ' ILE . . . . . 0.619 ' C ' HD12 ' B' ' 204' ' ' ILE . 1.0 OUTLIER -141.34 158.21 22.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.546 179.53 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 205' ' ' VAL . . . . . 0.61 ' N ' HD12 ' B' ' 204' ' ' ILE . 12.3 m -134.54 157.17 41.17 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.327 179.119 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 206' ' ' TYR . . . . . 0.589 ' O ' HD11 ' B' ' 161' ' ' LEU . 79.7 m-85 -108.53 137.22 46.84 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.303 -179.813 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 40.1 t -150.75 169.93 20.45 Favored 'General case' 0 C--O 1.222 -0.391 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 208' ' ' LEU . . . . . 0.427 HD22 ' N ' ' B' ' 208' ' ' LEU . 4.4 mm? -62.27 153.69 29.96 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.718 179.23 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -50.51 -46.77 57.37 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.479 179.761 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 210' ' ' ASP . . . . . 0.523 ' OD2' ' CG ' ' B' ' 212' ' ' HIS . 31.5 t70 -156.42 166.14 34.3 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.911 0.386 . . . . 0.0 110.485 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 211' ' ' THR . . . . . 0.561 ' O ' ' HB3' ' B' ' 214' ' ' ALA . 74.1 p -67.27 -32.09 72.87 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.622 -179.773 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 212' ' ' HIS . . . . . 0.523 ' CG ' ' OD2' ' B' ' 210' ' ' ASP . 29.9 m170 -39.46 -67.49 0.22 Allowed 'General case' 0 C--O 1.238 0.457 0 CA-C-O 121.308 0.575 . . . . 0.0 110.779 -179.936 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 59.3 t -45.99 -39.24 3.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.336 179.561 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 214' ' ' ALA . . . . . 0.561 ' HB3' ' O ' ' B' ' 211' ' ' THR . . . -62.49 -38.18 88.87 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.339 179.83 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 57.5 tt0 -60.44 -44.89 95.36 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.247 0.546 . . . . 0.0 109.994 -179.743 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 216' ' ' LEU . . . . . 0.524 ' CD1' ' N ' ' B' ' 216' ' ' LEU . 6.3 mp -61.99 -45.73 92.35 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-O 121.431 0.634 . . . . 0.0 110.39 -179.567 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 67.1 mt -66.55 -34.97 79.09 Favored 'General case' 0 C--O 1.218 -0.571 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.118 179.444 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -60.07 -42.67 95.06 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 -179.735 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 219' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -64.6 -47.79 77.3 Favored 'General case' 0 CA--C 1.52 -0.187 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 179.429 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 220' ' ' ALA . . . . . 0.414 ' HA ' HD21 ' A' ' 97' ' ' LEU . . . -62.94 -44.42 96.11 Favored 'General case' 0 CA--C 1.518 -0.262 0 C-N-CA 120.643 -0.423 . . . . 0.0 111.098 179.28 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 5.2 mm -63.93 -45.68 96.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 C-N-CA 120.729 -0.388 . . . . 0.0 110.98 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 89.7 t80 -63.65 -50.35 69.65 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.564 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 223' ' ' HIS . . . . . . . . . . . . . 52.0 t-80 -60.58 -33.34 72.58 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.691 -179.721 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 10.6 t -76.4 -50.79 13.26 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.918 0.39 . . . . 0.0 111.501 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -64.34 -24.16 67.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.705 -179.793 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 32.9 t60 -58.15 -72.39 0.09 Allowed 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.552 -0.459 . . . . 0.0 110.476 -179.18 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 227' ' ' LEU . . . . . . . . . . . . . 46.9 mt -80.44 -47.22 14.68 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.98 0.419 . . . . 0.0 110.48 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 228' ' ' HIS . . . . . 0.416 ' ND1' ' O ' ' B' ' 228' ' ' HIS . 53.2 t-80 44.94 51.52 8.62 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.792 -179.904 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 229' ' ' LEU . . . . . . . . . . . . . 66.6 mt -62.95 -41.68 99.58 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.61 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . 88.27 -105.17 3.11 Favored Glycine 0 CA--C 1.525 0.666 0 N-CA-C 110.911 -0.876 . . . . 0.0 110.911 -179.907 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 231' ' ' LEU . . . . . 0.59 ' N ' HD12 ' B' ' 231' ' ' LEU . 9.9 mp 42.49 61.07 2.15 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.873 0.368 . . . . 0.0 110.585 -179.881 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 232' ' ' SER . . . . . . . . . . . . . 49.9 m -62.37 -43.15 99.5 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.57 179.83 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 233' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 54.14 28.2 8.67 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.518 -179.844 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 234' ' ' ARG . . . . . . . . . . . . . 89.4 mtm180 -143.02 13.38 1.85 Allowed 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.756 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 235' ' ' HIS . . . . . 0.62 ' N ' ' CD ' ' B' ' 236' ' ' PRO . 0.9 OUTLIER -66.45 -41.81 43.34 Favored Pre-proline 0 C--N 1.327 -0.396 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.496 179.657 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 236' ' ' PRO . . . . . 0.62 ' CD ' ' N ' ' B' ' 235' ' ' HIS . 35.5 Cg_exo -60.02 144.12 99.5 Favored 'Trans proline' 0 C--N 1.309 -1.507 0 C-N-CA 122.599 2.199 . . . . 0.0 112.013 -179.172 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 237' ' ' SER . . . . . 0.404 ' O ' ' O ' ' B' ' 238' ' ' ALA . 19.5 m -61.31 -40.6 94.79 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.306 179.53 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 238' ' ' ALA . . . . . 0.404 ' O ' ' O ' ' B' ' 237' ' ' SER . . . 46.82 96.09 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.527 -179.86 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.723 0 CA-C-O 117.953 -1.471 . . . . 0.0 110.911 -179.976 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.26 0 N-CA-C 109.529 -1.429 . . . . 0.0 109.529 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 98.8 m-70 41.68 -118.38 0.41 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.725 0.298 . . . . 0.0 110.618 -179.9 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 66.44 32.29 81.36 Favored Glycine 0 CA--C 1.524 0.631 0 N-CA-C 110.911 -0.876 . . . . 0.0 110.911 179.813 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 34.7 m -72.58 131.63 34.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.924 0.392 . . . . 0.0 110.486 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 16.3 mm-40 -89.85 -172.83 3.68 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.448 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLY . . . . . 0.54 ' O ' ' N ' ' A' ' 9' ' ' ASN . . . -162.56 -117.24 0.41 Allowed Glycine 0 CA--C 1.522 0.485 0 N-CA-C 110.887 -0.885 . . . . 0.0 110.887 -179.876 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.401 ' O ' ' O ' ' A' ' 9' ' ' ASN . 77.1 ttt180 40.84 -90.3 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.628 0.252 . . . . 0.0 110.764 -179.701 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.54 ' N ' ' O ' ' A' ' 7' ' ' GLY . 93.4 m-20 45.71 -171.29 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.542 179.829 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 66.2 mtt85 56.58 75.87 0.54 Allowed Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.539 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_exo -60.31 143.95 99.5 Favored 'Trans proline' 0 C--N 1.306 -1.687 0 C-N-CA 122.881 2.387 . . . . 0.0 112.013 179.838 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 48.3 p 42.59 73.87 0.13 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.718 179.767 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.629 ' N ' ' CD ' ' A' ' 14' ' ' PRO . . . -100.62 -41.06 0.22 Allowed Pre-proline 0 N--CA 1.466 0.357 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.653 179.83 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.629 ' CD ' ' N ' ' A' ' 13' ' ' ALA . 24.5 Cg_exo -62.32 32.44 0.07 OUTLIER 'Trans proline' 0 C--N 1.309 -1.521 0 C-N-CA 122.952 2.435 . . . . 0.0 112.122 -179.806 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.519 ' H ' ' C ' ' A' ' 13' ' ' ALA . 63.1 mt -64.87 136.2 56.59 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 110.052 -0.351 . . . . 0.0 110.052 -179.846 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.431 ' O ' ' OD1' ' A' ' 16' ' ' ASP . 66.8 t0 -34.0 -33.05 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.273 0 O-C-N 123.533 0.521 . . . . 0.0 110.769 -179.669 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.49 ' N ' ' O ' ' A' ' 15' ' ' LEU . 83.8 p -45.25 -50.78 11.49 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.147 179.246 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.409 ' NE2' HD21 ' B' ' 229' ' ' LEU . 62.3 tt0 -63.44 -42.18 98.66 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.078 179.739 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.463 ' O ' HG23 ' A' ' 23' ' ' VAL . . . -57.49 -35.57 70.38 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.25 179.714 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.64 -53.47 33.69 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 110.181 -0.303 . . . . 0.0 110.181 179.573 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.46 -40.42 94.44 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.682 -179.644 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -61.33 -52.42 64.74 Favored 'General case' 0 C--O 1.242 0.704 0 CA-C-O 121.265 0.555 . . . . 0.0 110.48 -179.883 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.463 HG23 ' O ' ' A' ' 19' ' ' ALA . 83.5 t -62.18 -46.19 97.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.052 179.616 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -52.93 -43.63 66.41 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 120.87 -0.332 . . . . 0.0 110.207 179.748 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.9 t -59.16 -43.23 92.08 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.234 -0.439 . . . . 0.0 109.927 179.879 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 97.2 m -62.43 -51.47 67.41 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 120.539 -0.464 . . . . 0.0 110.532 179.729 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.46 ' N ' ' CD1' ' A' ' 27' ' ' LEU . 7.5 mp -65.51 -20.46 66.35 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 116.563 -0.289 . . . . 0.0 110.68 179.61 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.516 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 58.8 tt0 -74.04 -60.99 2.01 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.504 179.577 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.447 ' HB1' HH12 ' A' ' 35' ' ' ARG . . . -59.68 -54.43 46.53 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.802 -179.385 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.531 HD13 HD13 ' A' ' 39' ' ' LEU . 4.0 mm? -47.73 -30.44 3.87 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.187 -179.205 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.516 ' HB3' ' O ' ' A' ' 28' ' ' GLN . . . -58.9 -141.4 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.231 0.539 . . . . 0.0 110.453 179.661 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.407 ' O ' ' O ' ' A' ' 31' ' ' ALA . 3.3 m 59.48 115.76 0.02 OUTLIER Pre-proline 0 CA--C 1.541 0.609 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.149 -179.882 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -47.86 -53.15 7.02 Favored 'Trans proline' 0 C--N 1.31 -1.486 0 C-N-CA 122.306 2.004 . . . . 0.0 113.34 -179.068 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 78.0 p -53.01 -48.17 67.75 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.085 -178.576 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.447 HH12 ' HB1' ' A' ' 29' ' ' ALA . 82.8 mtp180 -67.77 -37.88 82.68 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 120.812 -0.355 . . . . 0.0 110.497 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.498 HD13 ' O ' ' A' ' 36' ' ' LEU . 0.2 OUTLIER -60.74 -52.76 63.73 Favored 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 120.25 -0.58 . . . . 0.0 110.86 -178.289 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.615 ' SD ' HD11 ' A' ' 56' ' ' ILE . 5.3 ttt -62.06 -48.12 81.67 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.755 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 94.7 mt -60.63 -45.65 97.04 Favored 'Isoleucine or valine' 0 C--O 1.243 0.741 0 CA-C-O 121.328 0.585 . . . . 0.0 110.481 -179.491 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.531 HD13 HD13 ' A' ' 30' ' ' LEU . 43.9 mt -60.68 -40.63 92.85 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.319 179.524 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 19.3 m -59.32 -43.17 92.71 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.024 179.062 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 67.0 tp60 -54.97 -47.03 75.1 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-O 120.984 0.421 . . . . 0.0 109.94 179.863 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.404 ' HA ' HD23 ' A' ' 42' ' ' LEU . 27.9 mt -65.89 -38.47 88.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.928 179.249 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 53.8 ttp180 -54.75 -44.08 73.3 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.09 -178.965 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -134.27 62.09 1.66 Allowed 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.844 0.354 . . . . 0.0 110.21 179.651 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 177.18 80.24 0.05 OUTLIER Glycine 0 CA--C 1.533 1.202 0 N-CA-C 110.686 -0.966 . . . . 0.0 110.686 -179.931 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -77.56 104.91 1.95 Allowed 'Trans proline' 0 N--CA 1.494 1.536 0 C-N-CA 122.491 2.128 . . . . 0.0 111.861 -179.365 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.524 ' H ' HD12 ' A' ' 47' ' ' LEU . 0.2 OUTLIER -155.88 156.43 30.54 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.342 -179.414 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -65.45 175.51 4.14 Favored 'Trans proline' 0 C--N 1.308 -1.595 0 C-N-CA 122.83 2.353 . . . . 0.0 111.975 179.633 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.545 HG23 ' N ' ' A' ' 50' ' ' THR . 5.1 m -63.91 -43.85 97.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.383 0.611 . . . . 0.0 110.994 -179.743 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.545 ' N ' HG23 ' A' ' 49' ' ' VAL . 0.2 OUTLIER -58.08 -65.78 0.59 Allowed 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.359 -179.718 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.467 ' H ' HG23 ' A' ' 50' ' ' THR . 41.2 t0 -50.68 -36.49 36.14 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 -179.61 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 9.5 tt -63.12 -41.51 99.34 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.31 179.317 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.26 -42.76 99.62 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-O 120.896 0.379 . . . . 0.0 110.241 -179.573 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -62.41 -41.72 98.9 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.113 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -66.68 -52.94 39.05 Favored 'General case' 0 CA--C 1.521 -0.157 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.847 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.718 HG23 ' O ' ' A' ' 56' ' ' ILE . 7.7 tt -175.07 84.1 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.881 -179.871 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -167.01 -59.29 0.03 OUTLIER Glycine 0 CA--C 1.525 0.688 0 N-CA-C 110.523 -1.031 . . . . 0.0 110.523 178.684 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 70.7 mtm 54.0 29.93 10.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.867 0.365 . . . . 0.0 110.451 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.522 ' O ' ' N ' ' A' ' 61' ' ' SER . 19.9 pt-20 -163.99 39.54 0.09 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.593 -179.879 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -40.54 -22.99 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.588 179.692 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.531 ' O ' ' ND1' ' A' ' 65' ' ' HIS . 78.0 p -67.84 -42.55 81.22 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.387 179.883 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.469 ' N ' ' O ' ' A' ' 59' ' ' GLU . . . -66.23 -35.15 79.68 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.313 179.539 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 92.1 t -66.99 -47.94 80.85 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.645 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 75.4 m -60.23 -43.14 96.29 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 120.926 -0.31 . . . . 0.0 110.473 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' HIS . . . . . 0.531 ' ND1' ' O ' ' A' ' 61' ' ' SER . 35.3 m80 -63.72 -49.94 71.09 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.608 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 93.9 mt-30 -63.71 -37.65 88.15 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.315 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 5.0 tt -62.28 -44.96 95.33 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.549 179.953 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 19.4 mmm180 -61.92 -41.93 98.5 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.839 0.352 . . . . 0.0 110.39 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 88.9 t -62.7 -55.13 25.67 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.133 0 C-N-CA 119.993 -0.683 . . . . 0.0 110.066 -179.838 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 81.2 mt -60.86 -35.47 76.68 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.29 -0.414 . . . . 0.0 109.948 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -57.83 -42.03 83.5 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.361 179.843 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -59.68 -45.9 90.7 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.497 -0.481 . . . . 0.0 110.383 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.547 HD22 ' N ' ' A' ' 73' ' ' LEU . 3.9 mm? -67.87 -41.8 82.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.762 179.505 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 109.76 91.77 2.15 Favored Glycine 0 CA--C 1.522 0.531 0 N-CA-C 110.953 -0.859 . . . . 0.0 110.953 -179.66 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 55.2 tp -156.84 -25.81 0.09 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.755 0.312 . . . . 0.0 110.577 179.401 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 19.2 m -136.98 158.82 36.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.46 179.833 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.481 HG12 ' N ' ' A' ' 78' ' ' GLY . 71.5 t -143.85 157.33 16.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.393 -179.761 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.481 ' N ' HG12 ' A' ' 77' ' ' VAL . . . -124.22 143.4 14.77 Favored Glycine 0 N--CA 1.462 0.382 0 N-CA-C 110.385 -1.086 . . . . 0.0 110.385 179.169 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 -118.0 138.33 52.26 Favored 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 110.024 -0.361 . . . . 0.0 110.024 -179.557 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 52.6 ptt85 -109.12 145.67 35.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.636 179.988 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.443 ' HB3' ' O ' ' A' ' 84' ' ' SER . . . -150.33 144.02 25.25 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.385 179.576 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -40.95 -39.08 1.86 Allowed Glycine 0 CA--C 1.524 0.633 0 N-CA-C 110.875 -0.89 . . . . 0.0 110.875 -179.852 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -72.56 -44.39 62.16 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.924 -0.311 . . . . 0.0 110.984 179.589 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' SER . . . . . 0.443 ' O ' ' HB3' ' A' ' 81' ' ' ALA . 3.7 m 177.74 -179.04 0.24 Allowed 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 121.064 0.459 . . . . 0.0 109.793 -178.991 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.632 ' C ' HD12 ' A' ' 85' ' ' ILE . 0.8 OUTLIER -116.75 153.28 18.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.905 179.636 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.626 ' N ' HD12 ' A' ' 85' ' ' ILE . 60.2 t -133.44 138.04 51.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.791 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.438 ' CE2' HD11 ' A' ' 85' ' ' ILE . 43.0 m-85 -100.38 132.9 45.5 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.298 178.795 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 48.2 t -150.73 170.97 17.93 Favored 'General case' 0 C--N 1.338 0.095 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.063 -179.907 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 47.2 mt -71.03 149.85 46.18 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.457 -179.718 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.421 ' O ' ' OD1' ' A' ' 91' ' ' ASP . 1.5 t80 -52.68 -51.34 60.65 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.485 -179.471 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.421 ' OD1' ' O ' ' A' ' 90' ' ' TYR . 98.9 m-20 -139.34 -171.15 3.06 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.412 -179.527 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 66.0 p -96.62 9.14 42.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.458 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 18.1 t-160 -52.39 -67.59 0.24 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.468 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 28.6 m -63.29 -34.35 66.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.34 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -56.46 -51.2 69.33 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.621 -179.839 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 -65.11 -42.92 93.54 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.26 179.781 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.605 ' CD1' ' HB2' ' B' ' 220' ' ' ALA . 14.4 tp -60.16 -46.64 89.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.169 0.509 . . . . 0.0 110.275 -179.66 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 71.2 mt -63.86 -37.98 89.4 Favored 'General case' 0 C--O 1.221 -0.415 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.251 179.515 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 66.1 t0 -59.47 -44.46 93.01 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.315 -179.705 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.445 ' O ' ' CG ' ' A' ' 104' ' ' HIS . 15.5 mm-40 -64.71 -50.22 67.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.7 -179.988 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.56 ' HB2' ' CD1' ' B' ' 216' ' ' LEU . . . -63.81 -40.45 96.66 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.415 -179.907 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 4.3 mm -63.75 -48.22 87.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.751 -179.037 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -67.11 -43.57 82.14 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.364 -179.71 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' HIS . . . . . 0.445 ' CG ' ' O ' ' A' ' 100' ' ' GLU . 58.1 m170 -62.76 -41.01 99.02 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.613 -179.422 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 23.3 t -76.21 -42.39 46.26 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.888 0.375 . . . . 0.0 110.923 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 85.0 tt0 -62.89 -28.8 70.29 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.547 -179.615 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 84.8 t60 -51.28 -69.58 0.11 Allowed 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.193 -179.073 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 9.7 tp -62.66 -41.87 99.31 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.769 -0.372 . . . . 0.0 110.3 -179.555 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' HIS . . . . . 0.541 ' CG ' ' H ' ' A' ' 110' ' ' LEU . 20.8 t60 74.21 -165.47 0.09 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.724 179.92 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.541 ' H ' ' CG ' ' A' ' 109' ' ' HIS . 10.3 mp -62.18 -42.53 99.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.461 -179.922 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 91.15 175.89 43.67 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 110.864 -0.894 . . . . 0.0 110.864 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.534 ' N ' HD22 ' A' ' 112' ' ' LEU . 3.9 mm? -63.39 -41.89 98.78 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.961 0.41 . . . . 0.0 110.812 -179.684 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 83.5 p -68.06 146.7 53.24 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.398 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 44.6 t0 -171.57 -90.08 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.521 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 73.1 ttp85 -76.4 138.36 40.34 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.512 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 49.02 59.18 17.45 Favored Pre-proline 0 C--N 1.331 -0.207 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.55 179.817 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -69.97 -21.46 32.47 Favored 'Trans proline' 0 C--N 1.307 -1.609 0 C-N-CA 122.624 2.216 . . . . 0.0 112.001 -179.741 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 19.4 m -75.67 154.24 36.66 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.56 -179.651 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -152.06 148.38 27.61 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.494 179.873 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.767 0 CA-C-O 117.923 -1.487 . . . . 0.0 110.995 179.97 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.263 0 N-CA-C 109.549 -1.421 . . . . 0.0 109.549 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 99.7 m-70 42.11 -122.32 0.59 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.717 0.294 . . . . 0.0 110.632 -179.888 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 123' ' ' GLY . . . . . . . . . . . . . . . 69.95 28.98 71.12 Favored Glycine 0 CA--C 1.523 0.564 0 N-CA-C 110.818 -0.913 . . . . 0.0 110.818 179.91 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 35.4 m -69.3 132.35 33.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.829 0.347 . . . . 0.0 110.565 -179.929 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 125' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -90.08 -172.98 3.69 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.501 179.949 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 126' ' ' GLY . . . . . 0.533 ' O ' ' N ' ' B' ' 128' ' ' ASN . . . -162.09 -118.3 0.46 Allowed Glycine 0 CA--C 1.522 0.53 0 N-CA-C 110.824 -0.911 . . . . 0.0 110.824 -179.936 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 127' ' ' ARG . . . . . . . . . . . . . 75.7 ttt180 41.53 -90.34 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.709 0.29 . . . . 0.0 110.804 -179.651 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 128' ' ' ASN . . . . . 0.533 ' N ' ' O ' ' B' ' 126' ' ' GLY . 89.0 m-20 45.44 -169.43 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.499 179.976 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 129' ' ' ARG . . . . . . . . . . . . . 66.8 mtt85 54.9 76.33 0.52 Allowed Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.598 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -60.94 145.29 99.29 Favored 'Trans proline' 0 C--N 1.307 -1.65 0 C-N-CA 122.915 2.41 . . . . 0.0 111.983 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 57.6 p 42.48 72.3 0.18 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.619 179.739 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 132' ' ' ALA . . . . . 0.622 ' N ' ' CD ' ' B' ' 133' ' ' PRO . . . -98.96 -42.39 0.23 Allowed Pre-proline 0 N--CA 1.467 0.41 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.273 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 133' ' ' PRO . . . . . 0.622 ' CD ' ' N ' ' B' ' 132' ' ' ALA . 25.3 Cg_exo -62.66 37.45 0.08 OUTLIER 'Trans proline' 0 C--N 1.311 -1.418 0 C-N-CA 122.994 2.463 . . . . 0.0 112.064 -179.928 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 134' ' ' LEU . . . . . 0.513 ' H ' ' C ' ' B' ' 132' ' ' ALA . 84.6 mt -70.48 135.97 49.07 Favored 'General case' 0 CA--C 1.512 -0.496 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 -179.736 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 135' ' ' ASP . . . . . 0.43 ' C ' ' O ' ' B' ' 134' ' ' LEU . 67.7 t0 -33.87 -33.22 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.269 0 O-C-N 123.508 0.505 . . . . 0.0 110.668 -179.609 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 136' ' ' SER . . . . . 0.497 ' N ' ' O ' ' B' ' 134' ' ' LEU . 57.4 p -45.55 -50.82 12.69 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.252 179.107 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 63.4 tt0 -63.94 -42.52 97.3 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.074 179.681 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 138' ' ' ALA . . . . . 0.496 ' O ' HG23 ' B' ' 142' ' ' VAL . . . -56.74 -35.61 68.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.207 179.832 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -66.69 -52.83 40.21 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 179.37 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -61.48 -40.33 94.14 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.71 -179.676 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -61.79 -52.02 65.92 Favored 'General case' 0 C--O 1.242 0.665 0 CA-C-O 121.233 0.54 . . . . 0.0 110.53 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 142' ' ' VAL . . . . . 0.496 HG23 ' O ' ' B' ' 138' ' ' ALA . 90.3 t -62.18 -46.12 97.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.024 179.611 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -52.89 -43.26 66.04 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 120.86 0.362 . . . . 0.0 110.256 179.693 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 11.6 t -59.47 -43.34 93.26 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.006 179.782 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 26.7 m -62.87 -50.98 68.78 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 120.586 -0.446 . . . . 0.0 110.589 179.466 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 146' ' ' LEU . . . . . 0.45 ' N ' ' CD1' ' B' ' 146' ' ' LEU . 7.7 mp -65.86 -20.56 66.28 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.69 -0.232 . . . . 0.0 110.773 179.643 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 147' ' ' GLN . . . . . 0.531 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 59.3 tt0 -74.51 -59.79 2.57 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.604 179.434 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -60.43 -55.05 38.24 Favored 'General case' 0 CA--C 1.522 -0.117 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.8 -179.263 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 149' ' ' LEU . . . . . 0.514 HD13 HD13 ' B' ' 158' ' ' LEU . 3.9 mm? -47.62 -29.53 3.0 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.239 -179.341 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 150' ' ' ALA . . . . . 0.531 ' HB3' ' O ' ' B' ' 147' ' ' GLN . . . -59.33 -143.51 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.203 0.525 . . . . 0.0 110.308 179.422 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 151' ' ' THR . . . . . . . . . . . . . 2.6 m 61.67 116.06 0.02 OUTLIER Pre-proline 0 C--N 1.322 -0.602 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.167 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_exo -48.4 -52.0 9.2 Favored 'Trans proline' 0 C--N 1.31 -1.496 0 C-N-CA 122.319 2.013 . . . . 0.0 113.364 -179.011 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 78.0 p -54.64 -48.4 72.31 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.027 -178.43 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 82.3 mtp180 -67.17 -37.73 84.22 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 120.853 -0.339 . . . . 0.0 110.588 -179.824 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 155' ' ' LEU . . . . . 0.518 ' O ' HD13 ' B' ' 155' ' ' LEU . 0.2 OUTLIER -60.73 -53.39 57.95 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 120.431 -0.508 . . . . 0.0 110.802 -178.491 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 156' ' ' MET . . . . . 0.568 ' SD ' HD11 ' B' ' 175' ' ' ILE . 4.5 ttt -61.06 -47.14 87.71 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.782 -179.851 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 96.1 mt -61.47 -44.56 98.77 Favored 'Isoleucine or valine' 0 C--O 1.243 0.749 0 CA-C-O 121.399 0.618 . . . . 0.0 110.356 -179.574 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 158' ' ' LEU . . . . . 0.514 HD13 HD13 ' B' ' 149' ' ' LEU . 33.7 mt -61.89 -40.13 94.35 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.151 179.901 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 16.2 m -60.47 -41.53 94.34 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.055 -0.521 . . . . 0.0 109.829 179.386 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 68.2 tp60 -57.06 -46.86 82.13 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.918 179.943 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 161' ' ' LEU . . . . . 0.421 HD23 ' HA ' ' B' ' 161' ' ' LEU . 32.6 mt -66.26 -38.6 88.22 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.836 179.376 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 162' ' ' ARG . . . . . 0.41 HH12 HG13 ' B' ' 221' ' ' ILE . 55.9 ttp180 -55.12 -43.76 74.39 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.226 -178.959 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -134.67 64.59 1.59 Allowed 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.948 0.404 . . . . 0.0 110.204 179.704 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . 173.8 77.58 0.05 OUTLIER Glycine 0 CA--C 1.531 1.037 0 N-CA-C 110.774 -0.931 . . . . 0.0 110.774 -179.762 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -75.35 106.4 2.26 Favored 'Trans proline' 0 N--CA 1.494 1.536 0 C-N-CA 122.547 2.165 . . . . 0.0 111.677 -179.541 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 166' ' ' LEU . . . . . 0.537 ' O ' HD12 ' B' ' 166' ' ' LEU . 0.3 OUTLIER -158.41 154.45 23.58 Favored Pre-proline 0 C--N 1.325 -0.5 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.425 -179.342 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -64.6 176.89 2.51 Favored 'Trans proline' 0 C--N 1.309 -1.52 0 C-N-CA 122.834 2.356 . . . . 0.0 112.218 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 168' ' ' VAL . . . . . 0.571 HG23 ' N ' ' B' ' 169' ' ' THR . 4.3 m -67.51 -45.52 85.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.885 -179.815 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 169' ' ' THR . . . . . 0.571 ' N ' HG23 ' B' ' 168' ' ' VAL . 0.0 OUTLIER -57.63 -41.35 81.17 Favored 'General case' 0 C--O 1.246 0.9 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.349 -179.632 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 38.0 t0 -72.67 -37.81 67.81 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.527 178.927 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 8.6 tt -64.39 -38.41 90.92 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.171 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 172' ' ' ALA . . . . . . . . . . . . . . . -63.81 -45.31 90.2 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.264 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -60.91 -42.37 97.93 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.342 -0.543 . . . . 0.0 110.292 179.67 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -67.7 -52.28 39.61 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.927 -179.463 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 175' ' ' ILE . . . . . 0.695 ' O ' HG23 ' B' ' 175' ' ' ILE . 4.8 tt -174.57 85.7 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.771 -179.745 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . -168.71 -61.38 0.03 OUTLIER Glycine 0 C--N 1.315 -0.596 0 N-CA-C 110.527 -1.029 . . . . 0.0 110.527 178.532 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 64.5 mtm 56.17 29.61 15.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.792 0.329 . . . . 0.0 110.492 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 178' ' ' GLU . . . . . 0.525 ' O ' ' N ' ' B' ' 180' ' ' SER . 20.8 pt-20 -163.19 39.93 0.1 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.625 -179.816 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 179' ' ' GLN . . . . . 0.406 ' HG2' ' H ' ' B' ' 179' ' ' GLN . 1.1 pt20 -40.75 -22.4 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.561 179.738 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 180' ' ' SER . . . . . 0.525 ' N ' ' O ' ' B' ' 178' ' ' GLU . 77.3 p -68.41 -42.68 78.65 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.383 179.686 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 181' ' ' ALA . . . . . 0.478 ' N ' ' O ' ' B' ' 178' ' ' GLU . . . -66.16 -35.56 80.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.348 179.556 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 99.0 t -66.96 -48.07 80.53 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.643 179.884 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 69.6 m -60.02 -43.44 95.27 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.841 0.353 . . . . 0.0 110.517 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 184' ' ' HIS . . . . . 0.512 ' ND1' ' O ' ' B' ' 180' ' ' SER . 33.8 m80 -63.37 -50.27 70.56 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-O 121.155 0.502 . . . . 0.0 110.739 -179.817 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 -63.62 -36.83 85.11 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.41 179.667 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 5.6 tt -62.47 -44.51 96.23 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.548 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 19.0 mmm180 -62.73 -42.15 99.52 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.863 0.363 . . . . 0.0 110.412 -179.833 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 71.5 t -62.13 -55.5 23.68 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 C-N-CA 119.989 -0.684 . . . . 0.0 110.066 -179.87 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 83.8 mt -60.67 -34.78 74.83 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.809 -0.441 . . . . 0.0 109.809 -179.629 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 76.3 ttt180 -58.13 -42.12 85.15 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.43 179.783 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -60.42 -46.47 89.91 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.582 -0.447 . . . . 0.0 110.445 -179.867 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 192' ' ' LEU . . . . . 0.538 ' N ' HD22 ' B' ' 192' ' ' LEU . 3.9 mm? -66.97 -41.69 86.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.658 179.56 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 109.14 93.38 2.27 Favored Glycine 0 CA--C 1.522 0.471 0 N-CA-C 110.85 -0.9 . . . . 0.0 110.85 -179.631 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 52.3 tp -158.83 -25.27 0.08 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.845 0.355 . . . . 0.0 110.542 179.491 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 24.1 m -137.95 159.82 33.35 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.346 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.407 179.85 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 196' ' ' VAL . . . . . 0.519 HG12 ' N ' ' B' ' 197' ' ' GLY . 73.8 t -145.35 159.16 13.13 Favored 'Isoleucine or valine' 0 C--O 1.232 0.137 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.361 -179.873 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 197' ' ' GLY . . . . . 0.519 ' N ' HG12 ' B' ' 196' ' ' VAL . . . -125.97 143.41 14.41 Favored Glycine 0 N--CA 1.463 0.45 0 N-CA-C 110.463 -1.055 . . . . 0.0 110.463 179.34 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 95.1 m-20 -117.27 138.49 51.7 Favored 'General case' 0 CA--C 1.514 -0.406 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 -179.57 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 52.7 ptt85 -108.52 144.51 36.08 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.798 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 200' ' ' ALA . . . . . 0.489 ' HB3' ' O ' ' B' ' 203' ' ' SER . . . -149.07 144.16 26.51 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.338 179.704 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 201' ' ' GLY . . . . . . . . . . . . . . . -41.33 -40.03 2.49 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 110.844 -0.902 . . . . 0.0 110.844 -179.907 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 202' ' ' ARG . . . . . . . . . . . . . 84.1 mtp180 -71.75 -44.6 63.79 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.921 -0.312 . . . . 0.0 110.889 179.628 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 203' ' ' SER . . . . . 0.489 ' O ' ' HB3' ' B' ' 200' ' ' ALA . 3.7 m 178.0 -179.57 0.28 Allowed 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 121.072 0.463 . . . . 0.0 109.813 -178.944 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 204' ' ' ILE . . . . . 0.588 HD11 ' CE2' ' B' ' 206' ' ' TYR . 0.9 OUTLIER -116.07 152.88 17.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 116.046 -0.524 . . . . 0.0 109.812 179.592 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 205' ' ' VAL . . . . . 0.537 ' N ' HD12 ' B' ' 204' ' ' ILE . 62.2 t -132.25 137.63 54.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.63 179.563 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 206' ' ' TYR . . . . . 0.588 ' CE2' HD11 ' B' ' 204' ' ' ILE . 46.5 m-85 -100.8 132.63 46.1 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.205 178.886 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 43.2 t -150.97 171.12 17.79 Favored 'General case' 0 C--O 1.231 0.093 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.197 -179.741 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . 41.7 mt -70.59 150.84 45.65 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.384 -179.576 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -53.85 -51.76 62.55 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.657 -0.417 . . . . 0.0 110.462 -179.63 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -138.87 -174.86 3.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.273 -179.372 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 68.2 p -92.6 7.99 40.96 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.451 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 212' ' ' HIS . . . . . . . . . . . . . 18.8 t-160 -51.11 -68.38 0.17 Allowed 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.039 0.447 . . . . 0.0 110.47 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 25.1 m -62.9 -32.87 57.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.295 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 214' ' ' ALA . . . . . . . . . . . . . . . -58.05 -50.37 73.68 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.594 -179.812 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -65.59 -43.17 90.54 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.212 179.827 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 216' ' ' LEU . . . . . 0.56 ' CD1' ' HB2' ' A' ' 101' ' ' ALA . 15.1 tp -60.24 -46.1 90.96 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.339 -179.526 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 79.3 mt -64.13 -38.55 91.46 Favored 'General case' 0 C--O 1.221 -0.406 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.332 179.373 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 63.9 t0 -59.45 -45.01 92.81 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.477 -179.879 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 219' ' ' GLU . . . . . 0.434 ' O ' ' CG ' ' B' ' 223' ' ' HIS . 15.8 mm-40 -64.23 -49.94 69.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.531 -179.921 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 220' ' ' ALA . . . . . 0.605 ' HB2' ' CD1' ' A' ' 97' ' ' LEU . . . -63.9 -40.97 97.73 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.328 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 221' ' ' ILE . . . . . 0.41 HG13 HH12 ' B' ' 162' ' ' ARG . 3.7 mm -63.45 -49.11 84.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 C-N-CA 120.639 -0.424 . . . . 0.0 110.764 -179.004 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -65.52 -44.56 86.55 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.836 0.351 . . . . 0.0 110.321 -179.799 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 223' ' ' HIS . . . . . 0.434 ' CG ' ' O ' ' B' ' 219' ' ' GLU . 62.3 m170 -61.81 -41.58 97.94 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.584 -179.485 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 5.5 t -75.07 -42.59 56.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.864 0.364 . . . . 0.0 111.153 179.932 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 80.0 tt0 -63.48 -26.86 68.91 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.462 -179.426 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 85.4 t60 -52.33 -70.29 0.09 Allowed 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 120.721 -0.391 . . . . 0.0 110.054 -179.032 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 227' ' ' LEU . . . . . . . . . . . . . 9.1 tp -62.92 -40.69 98.37 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.265 -179.615 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 228' ' ' HIS . . . . . 0.563 ' CG ' ' H ' ' B' ' 229' ' ' LEU . 23.1 t60 73.89 -164.64 0.09 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.631 179.913 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 229' ' ' LEU . . . . . 0.563 ' H ' ' CG ' ' B' ' 228' ' ' HIS . 10.4 mp -62.88 -41.96 99.6 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.343 -179.975 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . 92.54 175.29 41.69 Favored Glycine 0 CA--C 1.525 0.703 0 N-CA-C 110.791 -0.924 . . . . 0.0 110.791 -179.901 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 231' ' ' LEU . . . . . 0.543 HD22 ' N ' ' B' ' 231' ' ' LEU . 3.7 mm? -63.79 -41.02 98.01 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.953 0.406 . . . . 0.0 110.889 -179.775 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 232' ' ' SER . . . . . . . . . . . . . 12.1 p -69.84 147.51 50.26 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.357 -179.804 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 233' ' ' ASP . . . . . . . . . . . . . 64.2 t0 -170.94 -86.5 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.523 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 234' ' ' ARG . . . . . . . . . . . . . 73.1 ttp85 -79.38 137.25 37.22 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.459 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 235' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 50.95 57.8 17.15 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.585 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 236' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -68.48 -21.75 39.84 Favored 'Trans proline' 0 C--N 1.308 -1.595 0 C-N-CA 122.781 2.321 . . . . 0.0 111.938 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 237' ' ' SER . . . . . . . . . . . . . 21.5 m -75.78 153.7 36.78 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.518 -179.675 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 238' ' ' ALA . . . . . . . . . . . . . . . -151.22 151.2 31.53 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.493 179.783 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.764 0 CA-C-O 118.021 -1.433 . . . . 0.0 110.917 -179.968 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 38.1 m-20 . . . . . 0 C--O 1.238 0.471 0 CA-C-O 121.36 0.6 . . . . 0.0 111.088 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 96.7 p -55.88 -28.39 56.39 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.254 -179.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -70.91 -49.85 41.28 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.645 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.435 ' O ' HG23 ' A' ' 23' ' ' VAL . . . -55.34 -41.29 72.29 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 -179.741 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.8 -53.81 48.51 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 120.493 -0.483 . . . . 0.0 110.317 179.408 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.06 -47.73 80.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.9 0.381 . . . . 0.0 110.995 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 18.5 mm100 -56.58 -51.14 69.75 Favored 'General case' 0 C--O 1.24 0.604 0 CA-C-O 121.304 0.573 . . . . 0.0 110.488 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.435 HG23 ' O ' ' A' ' 19' ' ' ALA . 71.0 t -60.97 -43.12 95.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.814 179.674 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.485 ' HB2' HD12 ' B' ' 155' ' ' LEU . . . -50.83 -47.66 60.04 Favored 'General case' 0 C--O 1.223 -0.317 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.422 179.682 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 39.3 t -60.43 -43.15 97.08 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.084 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 21.7 m -63.34 -50.73 68.85 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.549 -0.46 . . . . 0.0 110.937 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 89.9 mt -70.13 -22.07 63.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.783 -179.487 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.488 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 55.3 tt0 -75.81 -55.1 5.96 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.661 178.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.48 -55.29 35.21 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 120.616 -0.434 . . . . 0.0 110.396 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.476 ' O ' ' O ' ' A' ' 31' ' ' ALA . 86.3 mt -45.99 -32.61 2.86 Favored 'General case' 0 CA--C 1.513 -0.447 0 C-N-CA 121.052 -0.259 . . . . 0.0 110.346 -179.202 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.488 ' HB3' ' O ' ' A' ' 28' ' ' GLN . . . -58.08 -126.84 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.282 179.575 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.512 ' HG1' ' HB3' ' A' ' 35' ' ' ARG . 0.6 OUTLIER 54.04 108.22 0.02 OUTLIER Pre-proline 0 CA--C 1.539 0.52 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.482 -179.721 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -48.77 -58.22 1.88 Allowed 'Trans proline' 0 N--CA 1.496 1.639 0 C-N-CA 122.265 1.977 . . . . 0.0 113.257 -179.752 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 5.4 t -57.26 -45.4 84.03 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.823 -178.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.512 ' HB3' ' HG1' ' A' ' 32' ' ' THR . 42.6 ttm180 -57.38 -44.05 84.12 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 120.806 -0.358 . . . . 0.0 110.778 -179.513 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.445 HD12 ' HB2' ' B' ' 143' ' ' ALA . 10.0 mt -62.64 -44.5 96.12 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.833 -0.347 . . . . 0.0 110.638 179.632 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 6.9 ttt -54.08 -48.77 70.31 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 120.371 -0.532 . . . . 0.0 110.222 179.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 47.8 mm -64.87 -43.03 96.37 Favored 'Isoleucine or valine' 0 C--O 1.236 0.39 0 CA-C-O 121.302 0.572 . . . . 0.0 110.528 179.387 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.614 ' O ' HD23 ' A' ' 39' ' ' LEU . 1.8 tt -61.6 -43.96 97.88 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.15 -179.308 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 12.0 m -59.26 -43.22 92.48 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.913 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 57.4 tp60 -55.56 -50.09 70.98 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.541 HD13 ' O ' ' A' ' 42' ' ' LEU . 0.2 OUTLIER -64.58 -42.92 95.3 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.96 0.886 . . . . 0.0 110.255 -179.498 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.51 ' O ' ' NE ' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -45.11 -35.79 3.31 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.389 -178.886 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 89.1 m-20 -61.29 -40.99 96.19 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.274 -179.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 167.1 170.9 32.55 Favored Glycine 0 CA--C 1.528 0.87 0 C-N-CA 120.549 -0.834 . . . . 0.0 111.25 178.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -62.6 150.49 87.59 Favored 'Trans proline' 0 N--CA 1.493 1.5 0 C-N-CA 122.733 2.289 . . . . 0.0 112.174 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 2.0 pp -175.14 145.03 0.85 Allowed Pre-proline 0 N--CA 1.449 -0.485 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.712 178.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -72.31 168.53 23.95 Favored 'Trans proline' 0 N--CA 1.498 1.742 0 C-N-CA 122.748 2.299 . . . . 0.0 112.28 178.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.5 HG23 ' N ' ' A' ' 50' ' ' THR . 9.0 m -63.26 -41.41 92.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.819 0.818 . . . . 0.0 110.603 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.5 ' N ' HG23 ' A' ' 49' ' ' VAL . 10.8 m -55.35 -41.01 71.95 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 114.756 -1.111 . . . . 0.0 110.479 179.538 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 89.2 m-20 -72.2 -42.92 65.26 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.086 0.47 . . . . 0.0 110.76 179.036 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.548 HD23 ' O ' ' A' ' 52' ' ' LEU . 1.1 tt -61.65 -36.14 79.94 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.088 -0.505 . . . . 0.0 109.91 -179.2 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.548 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -68.61 -48.51 63.92 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 116.175 -0.466 . . . . 0.0 109.854 179.818 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -53.15 -39.65 63.7 Favored 'General case' 0 C--O 1.232 0.166 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.392 179.529 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.47 -40.42 95.67 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.563 179.569 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 97.6 mt -89.89 -69.7 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.519 -0.227 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.362 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . 0.548 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 150.49 74.88 0.01 OUTLIER Glycine 0 CA--C 1.523 0.56 0 C-N-CA 120.869 -0.681 . . . . 0.0 111.677 179.421 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 34.2 ttm 61.27 77.01 0.35 Allowed 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.823 0.344 . . . . 0.0 110.968 179.036 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 88.1 mt-10 -150.29 21.57 0.84 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.694 179.653 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -60.44 -29.8 69.24 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.632 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 77.9 p -70.32 -45.91 65.27 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.641 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.415 ' O ' ' OE1' ' A' ' 66' ' ' GLN . . . -63.11 -32.06 73.35 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.926 179.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 77.1 t -69.18 -48.13 70.46 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.131 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.518 179.458 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 78.2 p -57.75 -41.88 82.82 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.642 -0.423 . . . . 0.0 110.424 -179.728 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' HIS . . . . . 0.432 ' O ' HG23 ' A' ' 69' ' ' VAL . 52.1 m80 -67.93 -43.67 78.61 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.945 179.606 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . 0.485 ' N ' ' OE1' ' A' ' 66' ' ' GLN . 0.7 OUTLIER -59.48 -51.62 69.09 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.022 0.439 . . . . 0.0 110.389 -179.242 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -61.51 -40.11 93.42 Favored 'General case' 0 CA--C 1.505 -0.761 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.267 -179.612 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -57.61 -44.84 85.77 Favored 'General case' 0 C--N 1.307 -1.28 0 CA-C-O 121.417 0.627 . . . . 0.0 110.446 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.432 HG23 ' O ' ' A' ' 65' ' ' HIS . 90.3 t -62.29 -53.97 40.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 C-N-CA 120.248 -0.581 . . . . 0.0 110.012 -179.775 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.456 ' O ' ' O ' ' A' ' 74' ' ' GLY . 4.2 mm? -61.51 -31.74 71.76 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.093 0.473 . . . . 0.0 110.242 -179.791 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.715 HH12 ' H ' ' A' ' 78' ' ' GLY . 59.9 ttt85 -59.29 -41.83 89.86 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.262 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 99.2 m-20 -63.72 -37.43 87.33 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.159 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.445 HD23 ' N ' ' A' ' 73' ' ' LEU . 5.8 mt -89.42 -7.08 55.89 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.458 -179.487 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . 0.596 ' C ' ' H ' ' A' ' 76' ' ' VAL . . . 89.56 -140.92 15.87 Favored Glycine 0 CA--C 1.521 0.43 0 N-CA-C 110.357 -1.097 . . . . 0.0 110.357 -179.814 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 38.2 mt 67.29 -29.47 0.15 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.727 0.298 . . . . 0.0 110.528 -179.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.596 ' H ' ' C ' ' A' ' 74' ' ' GLY . 3.3 m -134.34 156.67 40.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.148 179.486 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 54.7 t -137.7 146.99 26.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.367 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . 0.715 ' H ' HH12 ' A' ' 71' ' ' ARG . . . -121.47 140.92 14.25 Favored Glycine 0 C--N 1.335 0.514 0 N-CA-C 110.161 -1.176 . . . . 0.0 110.161 179.162 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 99.9 m-20 . . . . . 0 N--CA 1.466 0.345 0 CA-C-O 120.9 0.381 . . . . 0.0 110.384 -179.886 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 84.3 t . . . . . 0 N--CA 1.461 0.089 0 N-CA-C 110.24 -0.281 . . . . 0.0 110.24 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.514 ' O ' HD21 ' A' ' 42' ' ' LEU . 80.7 m-85 -106.37 131.63 53.36 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.384 179.685 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 93.7 p -150.16 170.47 18.87 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-O 120.842 0.354 . . . . 0.0 110.191 -179.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.662 ' N ' HD22 ' A' ' 89' ' ' LEU . 3.5 mm? -72.31 148.02 45.79 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.537 -179.576 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 26.4 t80 -51.7 -47.46 63.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.187 -179.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.49 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 19.7 p-10 -153.49 179.19 9.03 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.703 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . 0.467 ' O ' ' HB3' ' A' ' 95' ' ' ALA . 81.3 p -76.57 -17.91 58.95 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.609 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . 0.435 ' CD2' ' C ' ' A' ' 93' ' ' HIS . 12.1 t-160 -38.83 -69.39 0.13 Allowed 'General case' 0 C--O 1.236 0.368 0 CA-C-O 121.015 0.436 . . . . 0.0 110.777 -179.884 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 83.0 t -51.59 -41.16 27.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.969 -179.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.467 ' HB3' ' O ' ' A' ' 92' ' ' THR . . . -56.85 -47.82 79.5 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.666 -179.931 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 99.0 mm-40 -58.21 -47.81 82.33 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.122 -179.612 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.514 ' CD1' ' HB2' ' B' ' 220' ' ' ALA . 15.4 tp -59.38 -43.66 92.87 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.048 -179.577 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 87.1 mt -63.7 -40.37 96.62 Favored 'General case' 0 C--O 1.221 -0.427 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.433 179.812 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -59.02 -42.78 91.02 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.622 -179.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.516 ' O ' ' ND1' ' A' ' 104' ' ' HIS . 72.6 mm-40 -67.2 -48.69 67.13 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.786 -0.366 . . . . 0.0 110.764 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . 0.605 ' HB2' ' CD1' ' B' ' 216' ' ' LEU . . . -64.88 -50.57 66.07 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.159 -179.623 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.534 ' O ' HD13 ' A' ' 102' ' ' ILE . 0.3 OUTLIER -62.36 -45.93 97.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 C-N-CA 120.396 -0.522 . . . . 0.0 110.769 -178.687 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' TYR . . . . . 0.52 ' N ' ' CG2' ' A' ' 102' ' ' ILE . 75.3 t80 -63.01 -49.31 75.14 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.117 -178.678 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' HIS . . . . . 0.516 ' ND1' ' O ' ' A' ' 100' ' ' GLU . 23.6 m80 -63.34 -37.22 86.41 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.737 -179.84 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 5.0 t -74.95 -44.07 50.58 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.946 0.403 . . . . 0.0 111.261 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 10.2 tm-20 -69.39 -21.59 63.77 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.566 -179.636 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . 0.421 ' C ' ' ND1' ' A' ' 107' ' ' HIS . 0.3 OUTLIER . . . . . 0 N--CA 1.452 -0.333 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.344 -179.091 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 36.3 m-20 . . . . . 0 C--O 1.238 0.47 0 CA-C-O 121.283 0.563 . . . . 0.0 110.991 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 92.1 p -57.21 -28.72 63.13 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.333 -179.584 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 10.3 tp-100 -70.66 -49.59 45.68 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.66 179.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 138' ' ' ALA . . . . . 0.444 ' O ' HG23 ' B' ' 142' ' ' VAL . . . -55.69 -40.28 72.14 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 120.705 -0.398 . . . . 0.0 109.93 -179.614 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -63.07 -53.41 54.05 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 120.547 -0.461 . . . . 0.0 110.237 179.21 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -57.24 -47.5 81.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.867 0.365 . . . . 0.0 110.86 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 20.3 mm100 -55.99 -50.98 69.34 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-O 121.278 0.561 . . . . 0.0 110.452 -179.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 142' ' ' VAL . . . . . 0.444 HG23 ' O ' ' B' ' 138' ' ' ALA . 76.5 t -61.96 -42.95 96.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.864 179.734 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 143' ' ' ALA . . . . . 0.445 ' HB2' HD12 ' A' ' 36' ' ' LEU . . . -50.23 -48.6 54.4 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.269 179.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 38.1 t -60.42 -43.53 96.67 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.168 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 27.5 m -62.57 -50.48 71.13 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 120.556 -0.458 . . . . 0.0 111.026 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 91.3 mt -70.53 -21.6 62.71 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.901 -179.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 147' ' ' GLN . . . . . 0.469 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 58.3 tt0 -75.24 -56.98 4.18 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.561 179.144 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -59.65 -54.69 43.52 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.441 -179.454 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.487 ' O ' ' O ' ' B' ' 150' ' ' ALA . 81.0 mt -45.74 -34.5 3.65 Favored 'General case' 0 CA--C 1.514 -0.437 0 C-N-CA 120.976 -0.29 . . . . 0.0 110.455 -178.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 150' ' ' ALA . . . . . 0.487 ' O ' ' O ' ' B' ' 149' ' ' LEU . . . -57.57 -126.04 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.225 179.582 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 151' ' ' THR . . . . . 0.435 ' O ' ' O ' ' B' ' 150' ' ' ALA . 0.6 OUTLIER 54.35 108.22 0.02 OUTLIER Pre-proline 0 C--N 1.323 -0.579 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.49 -179.596 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_exo -48.26 -60.05 1.02 Allowed 'Trans proline' 0 N--CA 1.495 1.569 0 C-N-CA 122.256 1.97 . . . . 0.0 113.389 -179.769 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 39.8 t -56.64 -45.3 81.68 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.825 -178.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 154' ' ' ARG . . . . . 0.403 ' HB3' ' HG1' ' B' ' 151' ' ' THR . 42.0 ttm180 -57.17 -43.5 82.65 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 120.796 -0.362 . . . . 0.0 110.624 -179.583 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 155' ' ' LEU . . . . . 0.485 HD12 ' HB2' ' A' ' 24' ' ' ALA . 10.0 mt -63.1 -44.22 96.3 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.809 -0.357 . . . . 0.0 110.642 179.64 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 6.3 ttt -53.69 -48.76 69.22 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.358 -0.537 . . . . 0.0 110.158 179.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 41.8 mm -64.87 -43.43 96.33 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 CA-C-O 121.278 0.561 . . . . 0.0 110.524 179.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 158' ' ' LEU . . . . . 0.617 HD23 ' O ' ' B' ' 158' ' ' LEU . 1.7 tt -61.48 -43.5 98.76 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.064 -179.217 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 17.6 m -59.38 -43.51 92.88 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.033 -0.531 . . . . 0.0 109.996 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 61.3 tp60 -55.89 -49.97 71.93 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 120.483 -0.487 . . . . 0.0 109.811 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 161' ' ' LEU . . . . . 0.55 HD13 ' O ' ' B' ' 161' ' ' LEU . 0.2 OUTLIER -64.31 -41.83 96.63 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.733 0.778 . . . . 0.0 110.159 -179.454 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 162' ' ' ARG . . . . . 0.532 ' NE ' ' O ' ' B' ' 162' ' ' ARG . 0.0 OUTLIER -45.56 -36.4 4.63 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.261 -179.006 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -60.99 -41.64 96.89 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.214 -179.609 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . 167.61 171.85 34.05 Favored Glycine 0 CA--C 1.528 0.862 0 C-N-CA 120.582 -0.818 . . . . 0.0 111.341 178.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_exo -64.12 150.84 87.51 Favored 'Trans proline' 0 N--CA 1.494 1.508 0 C-N-CA 122.836 2.357 . . . . 0.0 112.215 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 1.8 pp -174.85 146.46 1.0 Allowed Pre-proline 0 C--N 1.326 -0.455 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.753 178.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -71.74 166.83 28.27 Favored 'Trans proline' 0 N--CA 1.495 1.614 0 C-N-CA 122.831 2.354 . . . . 0.0 112.316 178.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 168' ' ' VAL . . . . . 0.502 HG23 ' N ' ' B' ' 169' ' ' THR . 10.1 m -62.32 -40.9 89.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.83 0.824 . . . . 0.0 110.636 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 169' ' ' THR . . . . . 0.502 ' N ' HG23 ' B' ' 168' ' ' VAL . 7.4 m -56.83 -38.8 73.13 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 114.745 -1.116 . . . . 0.0 110.294 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 27.5 m-20 -71.7 -44.33 64.39 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.201 0.524 . . . . 0.0 110.335 179.346 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 171' ' ' LEU . . . . . 0.455 HD23 ' O ' ' B' ' 171' ' ' LEU . 0.7 OUTLIER -61.06 -32.54 72.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.16 -179.498 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 172' ' ' ALA . . . . . 0.541 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -70.99 -50.09 38.13 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.86 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -52.83 -38.82 61.86 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 120.515 -0.474 . . . . 0.0 110.336 179.607 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -64.76 -41.66 95.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.64 179.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 96.7 mt -89.4 -68.94 0.64 Allowed 'Isoleucine or valine' 0 CA--C 1.521 -0.139 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.329 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 176' ' ' GLY . . . . . 0.541 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 150.18 74.38 0.01 OUTLIER Glycine 0 CA--C 1.523 0.587 0 C-N-CA 120.959 -0.639 . . . . 0.0 111.633 179.373 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 33.4 ttm 61.38 78.15 0.3 Allowed 'General case' 0 C--O 1.232 0.148 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.866 179.293 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 88.2 mt-10 -150.56 23.09 0.8 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.628 179.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -61.78 -29.24 70.01 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.452 179.808 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 180' ' ' SER . . . . . 0.446 ' O ' ' ND1' ' B' ' 184' ' ' HIS . 78.3 p -70.28 -46.74 63.72 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.891 0.377 . . . . 0.0 110.463 -179.527 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 181' ' ' ALA . . . . . 0.409 ' O ' ' OE1' ' B' ' 185' ' ' GLN . . . -63.56 -30.97 72.01 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.931 179.691 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 54.2 t -69.34 -49.32 61.59 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.199 0 CA-C-O 121.135 0.493 . . . . 0.0 110.688 179.464 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 78.9 p -58.56 -40.61 83.53 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.653 -0.419 . . . . 0.0 110.463 -179.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 184' ' ' HIS . . . . . 0.446 ' ND1' ' O ' ' B' ' 180' ' ' SER . 51.4 m80 -67.92 -43.18 79.8 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.983 179.703 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 185' ' ' GLN . . . . . 0.476 ' N ' ' OE1' ' B' ' 185' ' ' GLN . 0.7 OUTLIER -60.49 -51.37 69.74 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.038 0.447 . . . . 0.0 110.491 -179.247 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -61.59 -39.65 91.97 Favored 'General case' 0 CA--C 1.506 -0.748 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.007 -179.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 15.1 tpt180 -57.91 -45.19 86.86 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-O 121.495 0.664 . . . . 0.0 110.46 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 73.9 t -62.21 -53.67 44.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 C-N-CA 120.159 -0.617 . . . . 0.0 109.96 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 189' ' ' LEU . . . . . 0.455 ' O ' ' O ' ' B' ' 193' ' ' GLY . 4.3 mm? -61.04 -31.88 71.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.09 0.472 . . . . 0.0 110.155 -179.751 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 190' ' ' ARG . . . . . 0.803 HH12 ' H ' ' B' ' 197' ' ' GLY . 60.4 ttt85 -59.61 -41.97 91.58 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.331 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 -63.57 -37.02 85.75 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 120.734 -0.386 . . . . 0.0 110.346 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 192' ' ' LEU . . . . . 0.454 ' N ' HD23 ' B' ' 192' ' ' LEU . 5.7 mt -89.56 -8.78 51.97 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.612 -179.364 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 193' ' ' GLY . . . . . 0.604 ' C ' ' H ' ' B' ' 195' ' ' VAL . . . 91.8 -141.72 15.75 Favored Glycine 0 CA--C 1.52 0.365 0 N-CA-C 110.389 -1.084 . . . . 0.0 110.389 -179.787 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 30.6 mt 67.86 -29.82 0.16 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.759 0.314 . . . . 0.0 110.613 -179.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 195' ' ' VAL . . . . . 0.604 ' H ' ' C ' ' B' ' 193' ' ' GLY . 3.1 m -136.18 158.34 38.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.29 179.735 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 196' ' ' VAL . . . . . . . . . . . . . 77.5 t -140.99 153.7 20.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.318 179.257 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 197' ' ' GLY . . . . . 0.803 ' H ' HH12 ' B' ' 190' ' ' ARG . . . -126.04 144.17 14.92 Favored Glycine 0 N--CA 1.464 0.505 0 N-CA-C 110.362 -1.095 . . . . 0.0 110.362 179.614 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 33.9 m-20 . . . . . 0 N--CA 1.465 0.316 0 CA-C-O 120.89 0.376 . . . . 0.0 110.614 179.904 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 96.6 t . . . . . 0 C--O 1.228 -0.073 0 N-CA-C 110.151 -0.314 . . . . 0.0 110.151 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 206' ' ' TYR . . . . . 0.439 ' O ' HD21 ' B' ' 161' ' ' LEU . 85.7 m-85 -106.92 132.52 52.78 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.418 179.716 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 51.5 p -151.36 171.36 17.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.281 -179.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 208' ' ' LEU . . . . . 0.682 HD22 ' N ' ' B' ' 208' ' ' LEU . 3.5 mm? -73.62 148.52 42.78 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.814 -179.692 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 23.4 t80 -51.63 -47.81 63.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.271 -179.806 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 210' ' ' ASP . . . . . 0.518 ' N ' ' OD1' ' B' ' 210' ' ' ASP . 14.3 p-10 -153.07 -179.46 7.71 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.809 0.338 . . . . 0.0 110.655 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 211' ' ' THR . . . . . 0.466 ' O ' ' HB3' ' B' ' 214' ' ' ALA . 65.1 p -77.81 -16.94 57.97 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.531 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 212' ' ' HIS . . . . . 0.412 ' NE2' ' CB ' ' A' ' 104' ' ' HIS . 11.9 t-160 -39.4 -69.63 0.12 Allowed 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.079 0.466 . . . . 0.0 110.831 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 87.0 t -50.75 -41.56 21.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.924 -179.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 214' ' ' ALA . . . . . 0.466 ' HB3' ' O ' ' B' ' 211' ' ' THR . . . -57.34 -47.2 82.19 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.918 0.389 . . . . 0.0 110.813 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -57.98 -47.39 83.13 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.138 -179.538 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 216' ' ' LEU . . . . . 0.605 ' CD1' ' HB2' ' A' ' 101' ' ' ALA . 14.1 tp -60.62 -43.56 97.36 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 120.449 -0.501 . . . . 0.0 110.049 -179.64 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 86.6 mt -63.56 -39.94 95.68 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.439 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -59.66 -42.08 92.02 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.487 -179.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 219' ' ' GLU . . . . . 0.459 ' O ' ' ND1' ' B' ' 223' ' ' HIS . 70.8 mm-40 -67.72 -49.2 63.86 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.796 -0.361 . . . . 0.0 110.742 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 220' ' ' ALA . . . . . 0.514 ' HB2' ' CD1' ' A' ' 97' ' ' LEU . . . -63.89 -51.3 65.16 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.986 -179.667 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 221' ' ' ILE . . . . . 0.553 HD13 ' O ' ' B' ' 221' ' ' ILE . 0.2 OUTLIER -62.26 -45.91 97.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 C-N-CA 120.419 -0.512 . . . . 0.0 110.667 -178.587 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 222' ' ' TYR . . . . . 0.508 ' N ' ' CG2' ' B' ' 221' ' ' ILE . 77.1 t80 -62.52 -49.29 75.95 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.06 -178.489 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 223' ' ' HIS . . . . . 0.459 ' ND1' ' O ' ' B' ' 219' ' ' GLU . 23.8 m80 -63.76 -36.54 84.21 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.737 -179.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 5.6 t -75.04 -44.66 46.5 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.927 0.394 . . . . 0.0 111.354 179.792 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 11.5 tm-20 -69.58 -21.67 63.59 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.596 -179.598 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.452 -0.346 0 C-N-CA 120.581 -0.448 . . . . 0.0 110.458 -179.145 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 . . . . . 0 C--O 1.234 0.245 0 CA-C-O 120.787 0.327 . . . . 0.0 110.927 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 11.9 t -58.22 -50.01 75.08 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.818 179.439 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -61.41 -43.13 99.4 Favored 'General case' 0 C--O 1.221 -0.407 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.393 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -55.3 -41.33 72.2 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.296 -179.714 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.05 -54.8 21.29 Favored 'General case' 0 C--N 1.333 -0.126 0 C-N-CA 120.672 -0.411 . . . . 0.0 110.835 179.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -58.58 -50.52 73.51 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.933 179.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.415 ' OE1' ' OG ' ' B' ' 224' ' ' SER . 54.5 tt0 -53.63 -50.69 65.15 Favored 'General case' 0 C--O 1.244 0.767 0 CA-C-O 121.061 0.458 . . . . 0.0 110.502 -179.766 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.432 ' O ' ' OG1' ' A' ' 26' ' ' THR . 49.1 t -61.5 -43.62 97.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.071 -0.513 . . . . 0.0 109.818 179.271 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.417 ' HB2' HD12 ' B' ' 155' ' ' LEU . . . -53.49 -47.24 70.0 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.308 -179.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 41.1 t -58.71 -43.66 90.17 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.508 -179.275 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.432 ' OG1' ' O ' ' A' ' 23' ' ' VAL . 12.7 p -65.45 -53.81 37.47 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 120.602 -0.439 . . . . 0.0 111.216 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.433 ' N ' ' CD1' ' A' ' 27' ' ' LEU . 8.0 mp -65.44 -23.13 66.86 Favored 'General case' 0 C--O 1.222 -0.39 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.941 -179.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.474 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 46.6 tt0 -73.11 -63.8 1.1 Allowed 'General case' 0 C--N 1.32 -0.682 0 O-C-N 123.39 0.431 . . . . 0.0 110.588 -179.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -54.94 -52.45 62.94 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.905 -179.111 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.405 ' O ' ' C ' ' A' ' 31' ' ' ALA . 4.1 mm? -53.44 -40.0 64.84 Favored 'General case' 0 CA--C 1.512 -0.516 0 C-N-CA 120.701 -0.399 . . . . 0.0 110.917 -179.636 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.587 ' O ' ' C ' ' A' ' 32' ' ' THR . . . -38.76 -73.1 0.05 Allowed 'General case' 0 CA--C 1.51 -0.59 0 O-C-N 123.637 0.585 . . . . 0.0 110.309 179.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.587 ' C ' ' O ' ' A' ' 31' ' ' ALA . 6.0 p -4.53 110.99 0.03 OUTLIER Pre-proline 0 CA--C 1.54 0.56 0 O-C-N 124.294 0.996 . . . . 0.0 111.134 179.241 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_exo -50.11 -45.52 32.81 Favored 'Trans proline' 0 C--N 1.303 -1.843 0 C-N-CA 122.231 1.954 . . . . 0.0 112.45 -177.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 66.7 m -56.98 -44.82 83.05 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.982 -179.105 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 77.6 mmt-85 -63.31 -38.32 90.7 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.063 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.424 ' CD1' ' O ' ' A' ' 31' ' ' ALA . 93.9 mt -64.66 -54.2 35.49 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.682 -0.407 . . . . 0.0 111.14 -179.614 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 10.7 tpt -54.34 -49.44 69.73 Favored 'General case' 0 C--O 1.239 0.539 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.394 -179.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 5.3 mm -62.77 -44.19 99.32 Favored 'Isoleucine or valine' 0 C--O 1.243 0.742 0 CA-C-O 121.22 0.533 . . . . 0.0 110.832 179.619 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 27.1 mt -61.41 -39.23 89.97 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.165 179.602 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 18.9 m -58.83 -40.37 83.99 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 179.554 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -60.55 -44.54 96.03 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 121.072 0.463 . . . . 0.0 110.077 179.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.511 HD21 HD13 ' A' ' 47' ' ' LEU . 13.8 mt -63.45 -37.94 89.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.746 179.158 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.425 ' C ' ' O ' ' A' ' 42' ' ' LEU . 77.4 ttt-85 -35.76 -30.04 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.482 -178.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.497 ' N ' ' O ' ' A' ' 42' ' ' LEU . 98.8 m-20 -65.34 -48.69 72.13 Favored 'General case' 0 C--N 1.334 -0.092 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.803 179.476 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.493 ' N ' ' O ' ' A' ' 42' ' ' LEU . . . 152.45 -79.52 0.2 Allowed Glycine 0 CA--C 1.528 0.863 0 N-CA-C 110.717 -0.953 . . . . 0.0 110.717 179.827 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -70.21 -172.88 0.67 Allowed 'Trans proline' 0 C--N 1.306 -1.692 0 C-N-CA 122.699 2.266 . . . . 0.0 111.937 179.513 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.511 HD13 HD21 ' A' ' 42' ' ' LEU . 6.8 tp -140.24 70.14 33.82 Favored Pre-proline 0 N--CA 1.454 -0.249 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.21 179.061 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_exo -62.42 91.73 0.13 Allowed 'Trans proline' 0 C--N 1.303 -1.839 0 C-N-CA 122.816 2.344 . . . . 0.0 110.973 177.442 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 55.0 t -55.91 -53.18 41.06 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 C-N-CA 120.639 -0.424 . . . . 0.0 111.62 -179.019 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.476 ' O ' ' OE1' ' A' ' 54' ' ' GLU . 29.0 p -63.07 -63.32 1.23 Allowed 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 120.894 0.378 . . . . 0.0 110.917 179.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.436 ' N ' ' OG1' ' A' ' 50' ' ' THR . 0.3 OUTLIER -46.14 -47.13 17.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.325 -178.723 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 68.1 mt -62.71 -38.62 91.16 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.582 179.184 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.431 ' HB3' ' O ' ' A' ' 50' ' ' THR . . . -54.13 -50.98 65.69 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.494 179.716 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.476 ' OE1' ' O ' ' A' ' 50' ' ' THR . 7.7 mp0 -63.77 -38.44 91.11 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.357 179.78 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . 0.445 ' O ' HG23 ' A' ' 56' ' ' ILE . . . -57.21 -61.37 2.51 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 120.365 -0.534 . . . . 0.0 111.326 -179.125 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.445 HG23 ' O ' ' A' ' 55' ' ' ALA . 15.0 pt -156.89 -10.28 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.731 -179.772 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -61.23 -55.43 29.39 Favored Glycine 0 C--N 1.335 0.526 0 N-CA-C 110.924 -0.87 . . . . 0.0 110.924 -178.727 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 78.9 mtp 45.55 25.82 0.27 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.684 0.278 . . . . 0.0 110.475 179.341 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.531 ' HG2' ' H ' ' A' ' 62' ' ' ALA . 73.2 tt0 -171.73 84.5 0.08 Allowed 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 109.77 -0.455 . . . . 0.0 109.77 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -63.7 -30.38 71.49 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.249 -179.204 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 35.5 t -64.14 -36.3 83.59 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.503 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.531 ' H ' ' HG2' ' A' ' 59' ' ' GLU . . . -67.71 -33.59 75.2 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.657 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 73.6 t -73.06 -52.84 20.42 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.919 -179.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 77.4 p -58.7 -44.58 90.38 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.316 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -62.78 -50.42 71.11 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.545 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 32.5 tt0 -60.9 -39.71 90.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.395 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 48.8 tp -61.12 -43.42 98.9 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.331 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -61.51 -40.59 95.17 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.403 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 97.9 t -61.7 -54.67 31.69 Favored 'Isoleucine or valine' 0 N--CA 1.46 0.069 0 C-N-CA 120.208 -0.597 . . . . 0.0 110.398 -179.479 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 10.9 mp -61.84 -33.79 74.79 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 179.612 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 26.2 tpt85 -58.4 -41.91 85.98 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.356 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 99.8 m-20 -60.72 -44.15 96.97 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.238 -179.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.407 ' HG ' ' H ' ' A' ' 73' ' ' LEU . 10.3 mt -63.87 -40.16 95.89 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.223 -179.801 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 103.94 19.27 12.07 Favored Glycine 0 CA--C 1.522 0.529 0 N-CA-C 110.869 -0.893 . . . . 0.0 110.869 -179.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.3 tp -80.54 -6.01 57.59 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.034 0.445 . . . . 0.0 110.694 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 34.6 m -139.27 163.26 26.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.298 -179.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.591 HG12 ' N ' ' A' ' 78' ' ' GLY . 77.7 t -149.49 164.43 3.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.789 179.867 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . 0.591 ' N ' HG12 ' A' ' 77' ' ' VAL . . . -107.65 147.05 16.32 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 110.445 -1.062 . . . . 0.0 110.445 179.374 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 . . . . . 0 N--CA 1.466 0.353 0 CA-C-O 120.762 0.315 . . . . 0.0 110.771 -179.931 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 29.3 m . . . . . 0 C--O 1.224 -0.254 0 CA-C-O 120.773 0.321 . . . . 0.0 110.605 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 78.4 m-85 -98.09 131.99 44.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.3 -179.429 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 66.0 p -145.49 166.74 24.8 Favored 'General case' 0 C--O 1.224 -0.243 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.142 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 44.8 mt -65.79 145.0 56.51 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.556 -179.607 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 12.7 t80 -50.47 -47.09 57.19 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.403 -179.511 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 23.6 p30 -141.69 169.73 17.04 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.861 0.362 . . . . 0.0 110.454 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . 0.514 ' O ' ' HB3' ' A' ' 95' ' ' ALA . 0.0 OUTLIER -85.71 -16.88 37.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.476 -179.756 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 -45.43 -65.02 0.6 Allowed 'General case' 0 C--O 1.237 0.429 0 CA-C-O 120.984 0.421 . . . . 0.0 110.589 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.419 HG13 ' N ' ' A' ' 95' ' ' ALA . 12.5 p -48.0 -36.63 5.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.303 -179.821 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.514 ' HB3' ' O ' ' A' ' 92' ' ' THR . . . -64.35 -37.64 88.24 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.241 179.452 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 66.5 tp60 -62.51 -47.28 84.65 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-O 121.275 0.56 . . . . 0.0 109.935 -179.595 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.61 HD21 ' HA ' ' B' ' 220' ' ' ALA . 7.1 mp -61.56 -42.75 99.3 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 120.424 -0.511 . . . . 0.0 110.214 -179.473 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 93.8 mt -66.97 -35.25 79.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.267 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 36.3 m-20 -60.78 -42.39 97.43 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.29 -0.413 . . . . 0.0 109.993 -179.408 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.497 ' C ' ' HD1' ' A' ' 104' ' ' HIS . 82.7 mt-10 -70.43 -52.81 19.56 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.383 179.197 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . 0.594 ' HA ' HD21 ' B' ' 216' ' ' LEU . . . -55.44 -45.81 76.79 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.627 179.563 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 5.1 mm -63.57 -44.92 98.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.87 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 89.6 t80 -63.96 -47.02 82.09 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.145 0.497 . . . . 0.0 110.61 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' HIS . . . . . 0.497 ' HD1' ' C ' ' A' ' 100' ' ' GLU . 51.8 m80 -60.62 -36.09 77.76 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.472 -179.735 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.421 ' OG ' ' OE1' ' B' ' 141' ' ' GLN . 38.9 t -76.52 -46.88 24.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.873 179.562 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -55.59 -28.21 53.77 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.359 -179.635 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 52.8 t-80 . . . . . 0 C--N 1.33 -0.25 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.685 179.708 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 . . . . . 0 C--O 1.238 0.476 0 CA-C-O 121.279 0.561 . . . . 0.0 110.591 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 11.4 t -59.26 -41.35 88.59 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.248 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 77.1 mt-30 -64.86 -46.28 82.51 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.44 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 138' ' ' ALA . . . . . . . . . . . . . . . -54.5 -41.56 69.75 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.183 -179.665 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -66.14 -54.3 27.17 Favored 'General case' 0 N--CA 1.457 -0.112 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.897 179.476 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -58.38 -51.27 70.54 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.976 179.594 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 141' ' ' GLN . . . . . 0.421 ' OE1' ' OG ' ' A' ' 105' ' ' SER . 57.1 tt0 -53.43 -49.86 66.44 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-O 121.084 0.469 . . . . 0.0 110.385 -179.747 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 142' ' ' VAL . . . . . . . . . . . . . 51.2 t -61.66 -43.25 96.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.699 179.186 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -54.44 -46.52 73.28 Favored 'General case' 0 C--O 1.217 -0.62 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.307 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 40.0 t -59.01 -44.01 91.64 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.508 -179.256 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 18.0 p -65.51 -53.8 37.26 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 120.619 -0.432 . . . . 0.0 111.216 179.875 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 146' ' ' LEU . . . . . 0.415 ' N ' ' CD1' ' B' ' 146' ' ' LEU . 8.2 mp -65.04 -23.11 67.09 Favored 'General case' 0 C--O 1.22 -0.453 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.016 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 147' ' ' GLN . . . . . 0.485 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 46.5 tt0 -73.66 -63.35 1.22 Allowed 'General case' 0 C--N 1.319 -0.741 0 O-C-N 123.364 0.415 . . . . 0.0 110.498 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -55.19 -52.92 61.8 Favored 'General case' 0 CA--C 1.521 -0.153 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.01 -179.085 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.411 ' O ' ' C ' ' B' ' 150' ' ' ALA . 4.1 mm? -52.96 -39.87 63.27 Favored 'General case' 0 CA--C 1.514 -0.429 0 C-N-CA 120.661 -0.415 . . . . 0.0 110.943 -179.773 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 150' ' ' ALA . . . . . 0.58 ' O ' ' C ' ' B' ' 151' ' ' THR . . . -39.19 -72.87 0.05 Allowed 'General case' 0 CA--C 1.511 -0.557 0 O-C-N 123.649 0.593 . . . . 0.0 110.285 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 151' ' ' THR . . . . . 0.58 ' C ' ' O ' ' B' ' 150' ' ' ALA . 6.8 p -4.77 110.3 0.03 OUTLIER Pre-proline 0 CA--C 1.54 0.582 0 O-C-N 124.279 0.987 . . . . 0.0 111.097 179.292 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_exo -49.4 -45.08 32.05 Favored 'Trans proline' 0 C--N 1.302 -1.875 0 C-N-CA 122.192 1.928 . . . . 0.0 112.487 -177.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 53.5 m -57.3 -44.85 84.45 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.983 -179.128 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 154' ' ' ARG . . . . . 0.621 ' NH1' HE21 ' B' ' 185' ' ' GLN . 77.2 mmt-85 -63.16 -39.01 93.42 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.996 -179.704 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 155' ' ' LEU . . . . . 0.417 HD12 ' HB2' ' A' ' 24' ' ' ALA . 94.4 mt -63.86 -54.41 35.27 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 120.733 -0.387 . . . . 0.0 111.102 -179.559 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 10.8 tpt -54.48 -49.65 69.61 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.489 -0.484 . . . . 0.0 110.461 -179.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 5.0 mm -62.21 -44.36 99.01 Favored 'Isoleucine or valine' 0 C--O 1.242 0.686 0 CA-C-O 121.328 0.585 . . . . 0.0 110.764 179.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 27.5 mt -61.81 -39.32 91.33 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.109 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 99.8 m -58.5 -40.64 83.39 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 179.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -60.73 -44.24 96.9 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 120.968 0.414 . . . . 0.0 109.927 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 161' ' ' LEU . . . . . 0.534 HD21 HD13 ' B' ' 166' ' ' LEU . 14.2 mt -63.72 -36.31 83.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.852 179.219 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 162' ' ' ARG . . . . . 0.421 ' C ' ' O ' ' B' ' 161' ' ' LEU . 77.4 ttt-85 -36.48 -30.63 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.471 -179.104 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 163' ' ' ASN . . . . . 0.476 ' N ' ' O ' ' B' ' 161' ' ' LEU . 96.4 m-20 -64.96 -50.25 67.15 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.834 179.81 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 164' ' ' GLY . . . . . 0.449 ' N ' ' O ' ' B' ' 161' ' ' LEU . . . 153.91 -78.01 0.2 Allowed Glycine 0 CA--C 1.528 0.891 0 N-CA-C 110.682 -0.967 . . . . 0.0 110.682 179.715 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -70.71 -171.43 0.55 Allowed 'Trans proline' 0 C--N 1.306 -1.709 0 C-N-CA 122.681 2.254 . . . . 0.0 111.96 179.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 166' ' ' LEU . . . . . 0.534 HD13 HD21 ' B' ' 161' ' ' LEU . 8.7 tp -142.25 69.9 22.34 Favored Pre-proline 0 C--N 1.331 -0.217 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.084 179.208 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_exo -63.02 91.83 0.14 Allowed 'Trans proline' 0 C--N 1.303 -1.863 0 C-N-CA 122.903 2.402 . . . . 0.0 111.123 177.774 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . 71.0 t -55.47 -53.29 37.62 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 C-N-CA 120.629 -0.429 . . . . 0.0 111.788 -178.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 169' ' ' THR . . . . . 0.476 ' O ' ' OE1' ' B' ' 173' ' ' GLU . 23.5 p -63.01 -63.1 1.3 Allowed 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.16 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 170' ' ' ASP . . . . . 0.442 ' N ' ' OG1' ' B' ' 169' ' ' THR . 0.8 OUTLIER -48.02 -44.97 31.44 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.159 -0.473 . . . . 0.0 109.966 -177.96 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 64.5 mt -63.52 -39.79 95.36 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.681 178.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 172' ' ' ALA . . . . . 0.409 ' HB3' ' O ' ' B' ' 169' ' ' THR . . . -53.31 -50.57 64.66 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.355 179.557 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 173' ' ' GLU . . . . . 0.476 ' OE1' ' O ' ' B' ' 169' ' ' THR . 8.7 mp0 -63.51 -38.86 92.77 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.382 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 174' ' ' ALA . . . . . 0.452 ' O ' HG23 ' B' ' 175' ' ' ILE . . . -56.76 -61.86 2.14 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 120.364 -0.534 . . . . 0.0 111.23 -179.077 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 175' ' ' ILE . . . . . 0.452 HG23 ' O ' ' B' ' 174' ' ' ALA . 15.5 pt -156.63 -9.76 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.752 -179.786 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . -61.51 -55.12 30.7 Favored Glycine 0 CA--C 1.521 0.467 0 N-CA-C 110.94 -0.864 . . . . 0.0 110.94 -178.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 76.5 mtp 45.43 26.37 0.29 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.706 0.288 . . . . 0.0 110.402 179.193 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 178' ' ' GLU . . . . . 0.471 ' HG2' ' H ' ' B' ' 181' ' ' ALA . 70.2 tt0 -172.6 85.34 0.06 Allowed 'General case' 0 CA--C 1.528 0.103 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -179.91 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -64.21 -29.84 70.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.289 -179.252 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 38.4 t -64.07 -37.74 88.54 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.534 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 181' ' ' ALA . . . . . 0.471 ' H ' ' HG2' ' B' ' 178' ' ' GLU . . . -66.71 -33.27 75.26 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.683 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 74.8 t -73.36 -53.05 19.22 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.15 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.866 -179.693 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 78.0 p -59.34 -44.03 92.7 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 -179.777 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 58.9 t-80 -63.9 -50.38 68.97 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-O 120.935 0.398 . . . . 0.0 110.653 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 185' ' ' GLN . . . . . 0.621 HE21 ' NH1' ' B' ' 154' ' ' ARG . 40.4 tt0 -61.27 -39.83 91.85 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.106 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 53.6 tp -60.92 -45.14 95.84 Favored 'General case' 0 C--O 1.222 -0.372 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.305 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -59.79 -41.66 91.67 Favored 'General case' 0 C--O 1.241 0.646 0 O-C-N 123.212 0.32 . . . . 0.0 110.415 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 88.1 t -59.26 -54.05 39.64 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.096 0 C-N-CA 120.241 -0.583 . . . . 0.0 110.076 -179.357 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 10.8 mp -62.13 -33.05 73.76 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.927 -0.398 . . . . 0.0 109.927 179.503 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -57.76 -41.41 81.88 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.26 -179.411 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -63.1 -40.48 97.77 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.425 -179.58 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 192' ' ' LEU . . . . . 0.412 ' N ' HD23 ' B' ' 192' ' ' LEU . 9.1 mt -66.27 -40.12 89.9 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.469 -179.489 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 103.44 17.13 18.41 Favored Glycine 0 CA--C 1.523 0.561 0 N-CA-C 110.923 -0.871 . . . . 0.0 110.923 -179.587 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 4.5 tp -80.24 -6.16 57.4 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.965 0.412 . . . . 0.0 110.656 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 34.3 m -138.67 162.5 29.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.33 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 196' ' ' VAL . . . . . 0.607 HG12 ' N ' ' B' ' 197' ' ' GLY . 71.3 t -149.28 164.16 4.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 120.905 0.384 . . . . 0.0 110.787 179.777 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 197' ' ' GLY . . . . . 0.607 ' N ' HG12 ' B' ' 196' ' ' VAL . . . -106.92 147.47 16.22 Favored Glycine 0 CA--C 1.523 0.575 0 N-CA-C 110.428 -1.069 . . . . 0.0 110.428 179.413 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 96.7 m-20 . . . . . 0 N--CA 1.466 0.359 0 CA-C-O 120.742 0.306 . . . . 0.0 110.579 -179.791 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 27.4 m . . . . . 0 N--CA 1.466 0.341 0 CA-C-O 120.899 0.38 . . . . 0.0 110.507 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 78.0 m-85 -97.58 131.18 44.41 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.229 -179.476 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 14.8 p -144.57 165.94 26.58 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.337 -179.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . 34.4 mt -65.51 146.01 55.39 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.485 -179.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 13.2 t80 -50.95 -48.46 60.93 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.337 -179.532 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 22.3 p30 -140.89 169.66 17.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.947 0.403 . . . . 0.0 110.441 -179.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 211' ' ' THR . . . . . 0.544 ' O ' ' HB3' ' B' ' 214' ' ' ALA . 0.1 OUTLIER -85.31 -17.28 37.31 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.384 -179.867 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 212' ' ' HIS . . . . . . . . . . . . . 85.3 m-70 -44.47 -65.49 0.51 Allowed 'General case' 0 C--O 1.237 0.412 0 CA-C-O 121.03 0.443 . . . . 0.0 110.569 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 11.4 p -48.28 -35.44 5.71 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.283 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 214' ' ' ALA . . . . . 0.544 ' HB3' ' O ' ' B' ' 211' ' ' THR . . . -64.79 -38.27 90.4 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.228 179.351 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 69.2 tp60 -62.21 -46.75 87.51 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 121.202 0.525 . . . . 0.0 110.021 -179.556 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 216' ' ' LEU . . . . . 0.594 HD21 ' HA ' ' A' ' 101' ' ' ALA . 6.8 mp -61.7 -43.54 98.67 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 120.437 -0.505 . . . . 0.0 110.239 -179.409 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 217' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' B' ' 217' ' ' LEU . 95.7 mt -66.1 -36.2 82.53 Favored 'General case' 0 C--O 1.222 -0.347 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.286 179.17 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 89.0 m-20 -59.76 -43.01 94.5 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.094 -179.434 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 219' ' ' GLU . . . . . 0.507 ' O ' ' ND1' ' B' ' 223' ' ' HIS . 96.7 mt-10 -69.57 -52.53 25.38 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.413 179.231 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 220' ' ' ALA . . . . . 0.61 ' HA ' HD21 ' A' ' 97' ' ' LEU . . . -56.5 -45.53 80.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.663 179.724 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 5.1 mm -63.27 -45.17 99.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.761 -179.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 91.0 t80 -63.91 -46.96 82.47 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.155 0.502 . . . . 0.0 110.676 179.646 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 223' ' ' HIS . . . . . 0.507 ' ND1' ' O ' ' B' ' 219' ' ' GLU . 46.2 m80 -60.36 -36.44 78.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.468 -179.623 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 224' ' ' SER . . . . . 0.415 ' OG ' ' OE1' ' A' ' 22' ' ' GLN . 10.2 t -76.36 -46.61 26.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.926 0.393 . . . . 0.0 110.836 179.643 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -55.44 -28.87 56.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.326 -179.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 55.6 t-80 . . . . . 0 C--N 1.332 -0.195 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.695 179.7 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 90.3 m-20 . . . . . 0 C--O 1.236 0.353 0 CA-C-O 121.123 0.487 . . . . 0.0 110.96 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 88.5 p -61.56 -37.51 84.08 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.347 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -66.17 -47.22 74.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.336 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.657 ' O ' HG23 ' A' ' 23' ' ' VAL . . . -56.24 -39.76 73.05 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.701 -0.4 . . . . 0.0 110.211 -179.753 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.565 ' HB1' ' HB3' ' B' ' 155' ' ' LEU . . . -64.04 -54.05 40.34 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.54 -0.464 . . . . 0.0 110.336 179.454 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -58.6 -47.93 82.68 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.29 -179.594 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -62.09 -50.97 69.81 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.984 -179.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.657 HG23 ' O ' ' A' ' 19' ' ' ALA . 95.1 t -61.25 -44.52 98.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.31 -179.699 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.1 -41.13 82.86 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.198 179.559 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 69.2 m -59.64 -43.64 93.79 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.137 179.616 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 85.7 m -62.91 -47.82 81.62 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.624 -0.43 . . . . 0.0 110.757 179.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 91.6 mt -67.82 -21.47 65.21 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.501 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.465 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 55.9 tt0 -75.33 -56.48 4.67 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.618 179.457 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.434 ' HB1' HH22 ' A' ' 35' ' ' ARG . . . -59.48 -53.9 52.78 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.614 -179.661 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.488 ' O ' ' O ' ' A' ' 31' ' ' ALA . 87.9 mt -47.13 -35.48 7.26 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 120.756 0.312 . . . . 0.0 110.196 -179.09 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.488 ' O ' ' O ' ' A' ' 30' ' ' LEU . . . -57.89 -140.35 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.44 179.103 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.432 ' O ' ' O ' ' A' ' 31' ' ' ALA . 47.2 m 57.65 112.75 0.02 OUTLIER Pre-proline 0 CA--C 1.54 0.574 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.98 -179.726 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . 0.419 ' O ' ' N ' ' A' ' 36' ' ' LEU . 51.3 Cg_exo -48.25 -59.07 1.38 Allowed 'Trans proline' 0 N--CA 1.495 1.617 0 C-N-CA 122.211 1.94 . . . . 0.0 113.306 -179.099 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 81.1 p -44.74 -48.36 10.78 Favored 'General case' 0 C--O 1.237 0.445 0 CA-C-O 121.18 0.514 . . . . 0.0 111.014 -178.66 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.434 HH22 ' HB1' ' A' ' 29' ' ' ALA . 84.2 mtp180 -72.46 -24.61 61.22 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.344 179.764 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.544 ' HB3' ' HB1' ' B' ' 139' ' ' ALA . 0.2 OUTLIER -67.2 -55.41 14.22 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 119.901 -0.72 . . . . 0.0 111.337 -178.542 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.417 ' HG2' ' H ' ' A' ' 37' ' ' MET . 5.2 ptp -64.78 -43.76 92.18 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.255 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 97.5 mt -63.12 -45.31 98.96 Favored 'Isoleucine or valine' 0 C--O 1.241 0.63 0 CA-C-O 121.415 0.626 . . . . 0.0 110.477 -179.313 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 5.3 tt -63.21 -41.23 99.11 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.599 179.72 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 31.7 m -59.26 -43.07 92.46 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.077 179.716 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 17.3 mm100 -56.85 -45.32 82.49 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.545 -0.462 . . . . 0.0 110.019 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.413 ' HA ' HD23 ' A' ' 42' ' ' LEU . 31.7 mt -66.5 -40.08 89.05 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.509 -0.477 . . . . 0.0 110.979 179.006 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 73.8 ttp85 -60.24 -34.2 73.35 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.682 -179.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -57.15 -40.11 76.55 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.262 -179.559 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 167.45 170.54 32.4 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 111.052 -0.819 . . . . 0.0 111.052 179.752 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -65.6 144.08 77.39 Favored 'Trans proline' 0 C--N 1.307 -1.624 0 C-N-CA 122.779 2.319 . . . . 0.0 111.809 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 1.9 pp -175.09 146.65 0.96 Allowed Pre-proline 0 C--N 1.325 -0.47 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.869 179.785 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -72.17 167.39 26.95 Favored 'Trans proline' 0 N--CA 1.495 1.566 0 C-N-CA 122.821 2.347 . . . . 0.0 112.19 179.333 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.431 ' CG2' ' N ' ' A' ' 50' ' ' THR . 3.1 m -62.38 -38.41 81.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 121.494 0.664 . . . . 0.0 110.425 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.431 ' N ' ' CG2' ' A' ' 49' ' ' VAL . 73.9 m -58.67 -44.65 90.24 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 114.526 -1.216 . . . . 0.0 110.293 179.781 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.422 ' O ' ' OD1' ' A' ' 51' ' ' ASP . 64.8 t0 -68.21 -37.2 80.63 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.923 -0.581 . . . . 0.0 109.907 178.579 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.672 HD13 ' C ' ' A' ' 52' ' ' LEU . 3.1 tm? -62.83 -44.34 96.41 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 119.988 -0.685 . . . . 0.0 110.25 -179.561 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.02 -43.32 99.07 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.587 179.834 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -60.19 -49.11 78.91 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 120.332 -0.547 . . . . 0.0 110.527 179.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.72 -52.35 57.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.035 -179.509 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.686 HG23 ' O ' ' A' ' 56' ' ' ILE . 7.6 tt -176.02 87.76 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.458 -0.073 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.941 -179.461 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -164.92 -57.17 0.02 OUTLIER Glycine 0 CA--C 1.52 0.389 0 N-CA-C 110.353 -1.099 . . . . 0.0 110.353 178.137 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 66.5 mtt 53.73 27.54 7.07 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.285 179.639 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.478 ' HG2' ' H ' ' A' ' 62' ' ' ALA . 70.6 tt0 -165.72 89.35 0.43 Allowed 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -74.1 -21.91 59.7 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.84 -179.328 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 78.1 p -67.15 -41.74 85.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.792 -179.873 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.478 ' H ' ' HG2' ' A' ' 59' ' ' GLU . . . -67.14 -32.12 73.03 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.473 179.78 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 83.6 t -69.99 -51.79 36.7 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.24 0 CA-C-N 116.488 -0.323 . . . . 0.0 110.778 179.829 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 99.3 p -60.33 -38.59 84.23 Favored 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 120.766 -0.374 . . . . 0.0 110.448 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 56.7 t-80 -66.39 -49.94 65.14 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-O 121.036 0.446 . . . . 0.0 110.703 -179.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 91.2 mm-40 -63.65 -38.01 89.51 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.242 179.658 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.412 HD21 ' CD1' ' A' ' 87' ' ' TYR . 7.5 tp -61.82 -45.27 94.54 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.002 -0.544 . . . . 0.0 109.776 -179.811 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 60.9 ttt85 -60.63 -45.16 95.09 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.499 -0.48 . . . . 0.0 110.483 -179.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 85.5 t -62.74 -54.65 31.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 C-N-CA 120.093 -0.643 . . . . 0.0 110.145 -179.457 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 78.4 mt -58.64 -35.15 72.07 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.08 0.467 . . . . 0.0 110.057 -179.196 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 70.0 ttt180 -60.43 -40.54 91.41 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.304 179.515 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 40.9 t-20 -62.36 -44.03 97.43 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 120.45 -0.5 . . . . 0.0 110.483 -179.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.482 HD23 ' N ' ' A' ' 73' ' ' LEU . 6.4 mt -67.88 -39.9 83.61 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.347 -179.212 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 104.66 29.0 5.48 Favored Glycine 0 CA--C 1.526 0.779 0 N-CA-C 110.808 -0.917 . . . . 0.0 110.808 -179.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 92.5 mt -90.28 -19.35 24.2 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.869 0.366 . . . . 0.0 110.838 179.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 21.8 m -135.82 158.25 39.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.097 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.426 HG23 ' CD2' ' A' ' 90' ' ' TYR . 39.3 t -141.59 155.88 20.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.508 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . 0.416 ' N ' ' CG1' ' A' ' 77' ' ' VAL . . . -117.68 142.19 17.01 Favored Glycine 0 CA--C 1.524 0.649 0 N-CA-C 110.185 -1.166 . . . . 0.0 110.185 178.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 . . . . . 0 N--CA 1.466 0.326 0 CA-C-O 120.745 0.307 . . . . 0.0 110.311 179.896 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.8 m . . . . . 0 N--CA 1.467 0.393 0 CA-C-O 120.837 0.351 . . . . 0.0 110.589 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.412 ' CD1' HD21 ' A' ' 67' ' ' LEU . 63.1 m-85 -106.81 133.64 51.16 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.061 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 74.5 m -151.23 171.71 16.98 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 64.0 mt -63.99 150.56 44.97 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.584 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.426 ' CD2' HG23 ' A' ' 77' ' ' VAL . 5.5 t80 -52.73 -48.65 66.52 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.398 -179.5 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 90.3 m-20 -139.71 166.92 23.32 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.078 0.466 . . . . 0.0 110.572 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . 0.481 ' O ' ' HB3' ' A' ' 95' ' ' ALA . 47.9 p -76.11 -24.22 54.96 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.835 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . 0.573 ' CB ' ' CE1' ' B' ' 223' ' ' HIS . 68.2 m80 -41.15 -60.12 1.32 Allowed 'General case' 0 C--O 1.237 0.416 0 CA-C-O 121.186 0.517 . . . . 0.0 110.72 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 10.8 m -55.81 -40.1 59.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.925 -0.58 . . . . 0.0 109.957 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.481 ' HB3' ' O ' ' A' ' 92' ' ' THR . . . -56.77 -41.15 77.1 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.987 0.422 . . . . 0.0 110.508 179.855 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.458 ' O ' ' OE1' ' A' ' 100' ' ' GLU . 6.1 tp-100 -64.76 -42.51 95.09 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.137 179.777 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 17.2 tp -59.6 -45.63 91.33 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.188 -0.605 . . . . 0.0 110.341 -178.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -65.51 -36.26 83.31 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.103 179.373 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 66.9 t0 -58.77 -43.17 90.33 Favored 'General case' 0 C--N 1.32 -0.706 0 C-N-CA 120.415 -0.514 . . . . 0.0 110.434 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.478 ' N ' ' OE1' ' A' ' 100' ' ' GLU . 2.7 mp0 -69.02 -50.41 49.04 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.484 179.786 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . 0.432 ' HB2' ' CD1' ' B' ' 216' ' ' LEU . . . -59.35 -44.67 92.64 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.759 -0.376 . . . . 0.0 110.38 -179.685 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.571 HD13 HG21 ' B' ' 142' ' ' VAL . 4.8 mm -62.76 -45.04 99.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 C-N-CA 120.666 -0.414 . . . . 0.0 110.42 -179.264 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 73.2 t80 -64.09 -44.45 92.29 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.057 0.456 . . . . 0.0 110.389 179.838 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' HIS . . . . . 0.551 ' CE1' ' CB ' ' B' ' 212' ' ' HIS . 25.7 t60 -59.14 -39.17 81.52 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.74 179.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 12.3 t -77.04 -44.57 30.28 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.918 0.39 . . . . 0.0 111.25 179.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 79.5 tt0 -55.82 -31.1 62.39 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.472 -179.173 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.328 -0.329 0 C-N-CA 120.388 -0.525 . . . . 0.0 110.195 -179.214 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 . . . . . 0 C--O 1.236 0.359 0 CA-C-O 121.117 0.484 . . . . 0.0 110.81 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 78.3 p -62.38 -37.0 84.06 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.328 179.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -66.2 -47.28 74.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.267 179.548 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 138' ' ' ALA . . . . . 0.652 ' O ' HG23 ' B' ' 142' ' ' VAL . . . -56.33 -39.61 73.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.076 -179.77 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 139' ' ' ALA . . . . . 0.544 ' HB1' ' HB3' ' A' ' 36' ' ' LEU . . . -64.23 -54.09 38.86 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.512 -0.475 . . . . 0.0 110.392 179.614 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -58.75 -48.03 82.61 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.326 -179.643 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -61.93 -51.21 69.06 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.22 0.533 . . . . 0.0 111.006 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 142' ' ' VAL . . . . . 0.652 HG23 ' O ' ' B' ' 138' ' ' ALA . 96.1 t -61.02 -44.3 97.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.214 -179.699 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -57.5 -41.53 80.95 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 110.062 -0.347 . . . . 0.0 110.062 179.717 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 68.0 m -59.54 -44.08 93.32 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.199 179.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 71.4 m -62.8 -48.51 78.81 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 120.99 0.424 . . . . 0.0 110.962 179.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 92.7 mt -67.38 -21.59 65.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.528 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 147' ' ' GLN . . . . . 0.471 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 56.2 tt0 -75.3 -56.24 4.92 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.634 179.367 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 148' ' ' ALA . . . . . 0.457 ' HB1' HH22 ' B' ' 154' ' ' ARG . . . -58.94 -53.96 52.47 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.687 -179.552 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.477 ' O ' ' O ' ' B' ' 150' ' ' ALA . 91.2 mt -47.37 -34.92 7.52 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-O 120.846 0.355 . . . . 0.0 110.179 -179.177 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 150' ' ' ALA . . . . . 0.477 ' O ' ' O ' ' B' ' 149' ' ' LEU . . . -58.74 -140.68 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.54 179.177 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 151' ' ' THR . . . . . 0.428 ' O ' ' O ' ' B' ' 150' ' ' ALA . 29.3 m 57.16 112.04 0.02 OUTLIER Pre-proline 0 CA--C 1.54 0.572 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.951 -179.517 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -47.47 -58.39 1.76 Allowed 'Trans proline' 0 N--CA 1.5 1.866 0 C-N-CA 122.396 2.064 . . . . 0.0 113.376 -179.068 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 88.6 p -45.18 -47.67 12.44 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 121.33 0.585 . . . . 0.0 110.858 -178.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 154' ' ' ARG . . . . . 0.457 HH22 ' HB1' ' B' ' 148' ' ' ALA . 83.6 mtp180 -73.52 -25.21 60.32 Favored 'General case' 0 C--N 1.319 -0.729 0 C-N-CA 120.338 -0.545 . . . . 0.0 110.291 179.802 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 155' ' ' LEU . . . . . 0.565 ' HB3' ' HB1' ' A' ' 20' ' ' ALA . 0.2 OUTLIER -66.42 -55.98 13.18 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 119.855 -0.738 . . . . 0.0 111.283 -178.337 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.66 -45.28 90.86 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.585 179.5 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 97.0 mt -62.59 -45.23 99.32 Favored 'Isoleucine or valine' 0 C--O 1.241 0.653 0 CA-C-O 121.496 0.665 . . . . 0.0 110.406 -179.207 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 5.8 tt -63.21 -41.24 99.12 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.685 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 83.3 m -59.14 -42.84 91.6 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.843 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 17.5 mm100 -57.0 -45.24 83.16 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.966 179.516 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 161' ' ' LEU . . . . . 0.407 ' HA ' HD23 ' B' ' 161' ' ' LEU . 33.2 mt -66.26 -40.68 90.32 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.415 -0.514 . . . . 0.0 111.104 178.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 162' ' ' ARG . . . . . . . . . . . . . 73.7 ttp85 -60.24 -33.07 71.77 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.704 -179.71 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 17.5 t-20 -58.45 -40.52 82.83 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.383 -179.501 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . 168.58 168.92 31.35 Favored Glycine 0 CA--C 1.525 0.673 0 N-CA-C 110.984 -0.846 . . . . 0.0 110.984 179.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -65.83 144.42 77.22 Favored 'Trans proline' 0 C--N 1.308 -1.58 0 C-N-CA 122.836 2.357 . . . . 0.0 111.824 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 2.0 pp -176.23 147.39 0.83 Allowed Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.888 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -72.79 169.14 22.75 Favored 'Trans proline' 0 N--CA 1.496 1.674 0 C-N-CA 122.631 2.221 . . . . 0.0 112.129 179.058 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 168' ' ' VAL . . . . . 0.424 HG23 ' N ' ' B' ' 169' ' ' THR . 3.8 m -63.28 -38.27 81.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 121.446 0.641 . . . . 0.0 110.514 -179.69 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 169' ' ' THR . . . . . 0.424 ' N ' HG23 ' B' ' 168' ' ' VAL . 71.5 m -58.5 -44.81 89.56 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 114.597 -1.183 . . . . 0.0 110.35 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 53.6 t0 -69.03 -36.46 77.78 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.822 178.661 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 171' ' ' LEU . . . . . 0.667 ' C ' HD13 ' B' ' 171' ' ' LEU . 3.1 tm? -63.42 -44.17 95.39 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.001 -0.68 . . . . 0.0 110.308 -179.669 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 172' ' ' ALA . . . . . . . . . . . . . . . -61.0 -43.43 98.9 Favored 'General case' 0 CA--C 1.512 -0.494 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.541 179.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -59.93 -48.19 82.72 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 120.284 -0.566 . . . . 0.0 110.403 179.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -65.04 -52.77 53.99 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.026 -179.513 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 175' ' ' ILE . . . . . 0.657 ' O ' HG23 ' B' ' 175' ' ' ILE . 7.7 tt -176.17 87.42 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.456 -0.131 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.963 -179.425 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . -164.38 -57.41 0.02 OUTLIER Glycine 0 CA--C 1.522 0.491 0 N-CA-C 110.528 -1.029 . . . . 0.0 110.528 178.25 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 65.3 mtt 53.69 27.47 6.91 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.88 -0.328 . . . . 0.0 110.438 179.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 178' ' ' GLU . . . . . 0.507 ' HG2' ' H ' ' B' ' 181' ' ' ALA . 73.8 tt0 -164.62 87.73 0.47 Allowed 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 11.5 mt-30 -73.48 -23.09 60.02 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.822 -179.312 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 78.2 p -66.92 -41.2 87.47 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.86 -179.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 181' ' ' ALA . . . . . 0.507 ' H ' ' HG2' ' B' ' 178' ' ' GLU . . . -66.96 -33.29 75.24 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.27 179.739 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 77.9 t -69.69 -51.27 42.64 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.197 0 C-N-CA 120.721 -0.392 . . . . 0.0 110.781 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 92.1 p -59.28 -41.65 89.42 Favored 'General case' 0 C--N 1.332 -0.154 0 C-N-CA 120.675 -0.41 . . . . 0.0 110.566 -179.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 63.5 t-80 -66.26 -48.49 70.32 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-O 121.114 0.483 . . . . 0.0 110.757 -179.838 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 2.9 tp-100 -63.81 -37.43 87.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.107 -179.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 186' ' ' LEU . . . . . 0.426 HD21 ' CD1' ' B' ' 206' ' ' TYR . 9.8 tp -63.22 -44.26 95.78 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.917 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 61.6 ttt85 -59.76 -44.34 93.91 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.614 -0.434 . . . . 0.0 110.23 -179.663 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 90.1 t -63.38 -54.28 34.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 C-N-CA 120.021 -0.672 . . . . 0.0 110.215 -179.669 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 85.6 mt -58.96 -36.09 74.23 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.161 0.505 . . . . 0.0 109.989 -179.111 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 70.1 ttt180 -60.21 -41.91 94.05 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.205 179.412 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 39.2 t-20 -60.37 -47.23 86.94 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 120.431 -0.508 . . . . 0.0 110.388 -179.291 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 192' ' ' LEU . . . . . . . . . . . . . 9.7 mt -65.06 -39.58 93.47 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.918 0.39 . . . . 0.0 110.565 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 193' ' ' GLY . . . . . 0.4 ' O ' ' CD2' ' B' ' 209' ' ' TYR . . . 104.41 28.77 5.63 Favored Glycine 0 CA--C 1.525 0.715 0 N-CA-C 110.855 -0.898 . . . . 0.0 110.855 -179.768 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 92.8 mt -88.86 -19.65 25.62 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.911 0.386 . . . . 0.0 110.758 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 24.6 m -136.05 158.94 39.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.157 -0.474 . . . . 0.0 109.99 179.705 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 196' ' ' VAL . . . . . 0.441 HG23 ' CD2' ' B' ' 209' ' ' TYR . 41.3 t -141.71 156.29 20.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.442 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 197' ' ' GLY . . . . . 0.414 ' N ' ' CG1' ' B' ' 196' ' ' VAL . . . -117.6 142.23 17.07 Favored Glycine 0 CA--C 1.525 0.703 0 N-CA-C 110.202 -1.159 . . . . 0.0 110.202 179.151 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 . . . . . 0 C--O 1.237 0.399 0 CA-C-O 120.664 0.269 . . . . 0.0 110.364 179.829 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 26.8 m . . . . . 0 N--CA 1.466 0.373 0 CA-C-O 120.783 0.325 . . . . 0.0 110.548 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 206' ' ' TYR . . . . . 0.426 ' CD1' HD21 ' B' ' 186' ' ' LEU . 65.7 m-85 -106.96 133.74 51.15 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.118 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 58.2 m -151.38 171.79 16.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.274 -179.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . 68.9 mt -64.53 150.2 47.19 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.487 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 209' ' ' TYR . . . . . 0.441 ' CD2' HG23 ' B' ' 196' ' ' VAL . 5.9 t80 -52.59 -47.44 66.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.394 -179.59 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 89.0 m-20 -140.19 167.4 22.22 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 121.165 0.507 . . . . 0.0 110.603 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 211' ' ' THR . . . . . 0.498 ' O ' ' HB3' ' B' ' 214' ' ' ALA . 40.9 p -78.17 -23.88 47.48 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.668 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 212' ' ' HIS . . . . . 0.551 ' CB ' ' CE1' ' A' ' 104' ' ' HIS . 65.1 m80 -41.4 -59.46 1.56 Allowed 'General case' 0 C--O 1.236 0.373 0 CA-C-O 121.25 0.547 . . . . 0.0 110.552 -179.892 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 8.7 m -55.87 -41.07 65.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.815 -0.63 . . . . 0.0 109.884 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 214' ' ' ALA . . . . . 0.498 ' HB3' ' O ' ' B' ' 211' ' ' THR . . . -55.52 -40.91 72.4 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.471 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 215' ' ' GLN . . . . . 0.439 ' O ' ' OE1' ' B' ' 219' ' ' GLU . 7.1 tp-100 -65.23 -42.78 93.04 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.217 179.733 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 216' ' ' LEU . . . . . 0.432 ' CD1' ' HB2' ' A' ' 101' ' ' ALA . 12.6 tp -59.25 -46.0 89.67 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.166 -0.614 . . . . 0.0 110.387 -178.784 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -64.98 -37.09 86.49 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.983 179.282 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 43.6 t0 -58.12 -42.42 85.72 Favored 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 120.496 -0.482 . . . . 0.0 110.49 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 219' ' ' GLU . . . . . 0.494 ' OE1' ' N ' ' B' ' 219' ' ' GLU . 2.4 mp0 -69.34 -51.67 34.74 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.505 179.732 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -58.33 -44.67 88.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.346 -179.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 221' ' ' ILE . . . . . 0.593 HD13 HG21 ' A' ' 23' ' ' VAL . 4.8 mm -62.67 -44.9 99.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.601 -179.265 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 74.5 t80 -64.55 -43.71 93.11 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.069 0.462 . . . . 0.0 110.299 179.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 223' ' ' HIS . . . . . 0.573 ' CE1' ' CB ' ' A' ' 93' ' ' HIS . 32.4 t60 -59.65 -38.96 82.85 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.693 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 9.7 t -77.1 -44.94 28.68 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.991 0.424 . . . . 0.0 111.295 179.593 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -55.93 -31.16 62.67 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.438 -179.229 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 1.2 t60 . . . . . 0 C--N 1.328 -0.331 0 C-N-CA 120.373 -0.531 . . . . 0.0 110.118 -179.326 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 . . . . . 0 C--O 1.234 0.284 0 CA-C-O 121.117 0.485 . . . . 0.0 111.169 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 58.5 m -53.86 -34.48 59.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.455 -179.22 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -68.03 -49.57 60.66 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.649 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.623 ' O ' HG23 ' A' ' 23' ' ' VAL . . . -54.74 -35.85 64.17 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 -179.934 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.32 -52.66 37.66 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.423 179.26 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.99 -49.2 77.63 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.797 0.332 . . . . 0.0 111.0 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 86.5 mt-30 -56.06 -50.95 69.54 Favored 'General case' 0 C--O 1.242 0.673 0 CA-C-O 121.279 0.561 . . . . 0.0 110.666 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.623 HG23 ' O ' ' A' ' 19' ' ' ALA . 90.6 t -60.49 -45.09 97.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.784 179.688 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.441 ' HB2' HD12 ' B' ' 155' ' ' LEU . . . -49.17 -46.17 45.04 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 121.014 -0.274 . . . . 0.0 110.391 179.216 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 36.0 t -59.56 -43.95 93.41 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.101 -0.499 . . . . 0.0 109.85 -179.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 20.2 m -65.68 -51.27 60.78 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.18 0.514 . . . . 0.0 110.812 179.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.544 ' CD1' HD13 ' B' ' 146' ' ' LEU . 4.1 mm? -62.26 -25.58 67.91 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.771 -179.896 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.493 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 54.7 tt0 -75.14 -53.38 8.95 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.849 179.499 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.47 -56.6 19.91 Favored 'General case' 0 CA--C 1.521 -0.171 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.838 -179.232 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.498 ' O ' ' O ' ' A' ' 31' ' ' ALA . 8.0 mp -45.11 -34.91 2.83 Favored 'General case' 0 CA--C 1.516 -0.364 0 C-N-CA 120.958 -0.297 . . . . 0.0 110.214 -179.237 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.498 ' O ' ' O ' ' A' ' 30' ' ' LEU . . . -57.31 -140.48 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.17 0.51 . . . . 0.0 110.357 179.291 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 37.7 m 59.66 110.1 0.02 OUTLIER Pre-proline 0 C--N 1.325 -0.487 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.308 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -51.15 -52.57 8.8 Favored 'Trans proline' 0 N--CA 1.496 1.641 0 C-N-CA 122.372 2.048 . . . . 0.0 113.155 -179.022 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 64.7 m -55.7 -45.48 77.85 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.902 -178.585 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 36.8 ttm180 -61.97 -44.44 96.75 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.733 -179.555 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.405 HD12 ' HB2' ' B' ' 143' ' ' ALA . 8.3 mt -62.08 -48.45 80.16 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.809 -0.356 . . . . 0.0 110.866 -179.666 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.468 ' O ' ' OG1' ' A' ' 40' ' ' THR . 49.8 ttp -53.95 -48.84 69.86 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-O 121.233 0.539 . . . . 0.0 110.204 179.612 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 97.9 mt -64.59 -42.72 95.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 121.342 0.591 . . . . 0.0 110.315 179.451 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 12.0 tp -62.24 -42.77 99.62 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.683 -179.273 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.468 ' OG1' ' O ' ' A' ' 37' ' ' MET . 21.3 p -59.52 -38.78 81.88 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.2 -0.455 . . . . 0.0 109.847 179.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.55 ' OE1' HD21 ' A' ' 52' ' ' LEU . 86.8 mt-30 -60.96 -46.47 90.6 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.536 -0.466 . . . . 0.0 110.005 178.798 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 92.8 mt -63.57 -38.78 92.45 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.755 179.268 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.42 ' O ' ' ND2' ' A' ' 44' ' ' ASN . 72.5 ttp85 -50.81 -42.82 58.6 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.418 -179.416 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.42 ' ND2' ' O ' ' A' ' 43' ' ' ARG . 12.8 m120 -135.36 48.81 2.22 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.375 179.582 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -175.23 78.77 0.08 OUTLIER Glycine 0 CA--C 1.529 0.959 0 N-CA-C 111.046 -0.822 . . . . 0.0 111.046 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -79.41 112.38 2.98 Favored 'Trans proline' 0 C--N 1.31 -1.461 0 C-N-CA 122.745 2.297 . . . . 0.0 111.504 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.575 HD12 ' O ' ' A' ' 47' ' ' LEU . 0.3 OUTLIER -160.75 156.01 21.16 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.622 -178.936 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -66.04 -178.66 1.12 Allowed 'Trans proline' 0 C--N 1.309 -1.527 0 C-N-CA 122.696 2.264 . . . . 0.0 111.89 179.034 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.571 HG23 ' N ' ' A' ' 50' ' ' THR . 3.5 m -68.06 -45.7 82.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 121.559 0.695 . . . . 0.0 111.383 -179.836 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.571 ' N ' HG23 ' A' ' 49' ' ' VAL . 58.3 p -55.85 -41.22 74.01 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.364 -0.834 . . . . 0.0 110.454 -179.516 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 66.9 m-20 -74.55 -40.24 61.82 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.507 179.457 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.74 HD23 ' O ' ' A' ' 52' ' ' LEU . 3.7 tt -60.98 -38.43 85.95 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.825 -179.658 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.585 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -69.63 -45.37 68.65 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.146 179.442 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 81.8 tt0 -52.76 -43.42 65.77 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.767 -0.373 . . . . 0.0 110.089 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -62.33 -42.95 99.8 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.538 179.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 96.6 mt -84.44 -67.12 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.454 179.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . 0.585 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 143.73 70.93 0.02 OUTLIER Glycine 0 CA--C 1.523 0.574 0 N-CA-C 111.141 -0.784 . . . . 0.0 111.141 179.672 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.426 ' C ' ' SD ' ' A' ' 58' ' ' MET . 2.7 tmm? 68.31 97.53 0.06 Allowed 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.76 -0.376 . . . . 0.0 110.762 179.647 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -173.85 24.9 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.078 0.466 . . . . 0.0 110.41 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -70.75 -23.58 62.45 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.044 0.45 . . . . 0.0 110.359 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 9.6 t -66.27 -44.37 83.8 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.584 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.1 -33.22 71.81 Favored 'General case' 0 C--O 1.24 0.605 0 CA-C-N 115.936 -0.575 . . . . 0.0 109.978 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 80.6 t -66.94 -49.99 68.79 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.083 179.713 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 50.5 m -53.04 -42.55 65.86 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 120.985 0.421 . . . . 0.0 110.163 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 83.4 t60 -58.3 -41.26 84.05 Favored 'General case' 0 C--O 1.242 0.697 0 CA-C-O 121.38 0.61 . . . . 0.0 109.63 178.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 55.1 tt0 -60.45 -38.86 85.51 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.859 -0.61 . . . . 0.0 109.993 179.249 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.644 ' HA ' HD23 ' A' ' 70' ' ' LEU . 24.0 mt -62.19 -42.35 99.2 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.391 179.861 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -55.26 -47.19 75.83 Favored 'General case' 0 C--O 1.24 0.575 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.874 179.481 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 90.7 t -68.31 -48.76 71.74 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.153 0 CA-C-O 121.172 0.51 . . . . 0.0 110.403 178.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.9 HD22 ' CG2' ' A' ' 76' ' ' VAL . 0.1 OUTLIER -49.06 -45.54 43.15 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 -179.277 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.632 ' N ' ' HG ' ' A' ' 70' ' ' LEU . 90.5 mtt-85 -62.35 -43.76 98.07 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.791 -178.508 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.43 ' C ' HD22 ' A' ' 73' ' ' LEU . 99.2 m-20 -65.34 -41.22 94.13 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.598 179.226 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.543 HD22 ' N ' ' A' ' 73' ' ' LEU . 4.0 mm? -95.61 -64.32 1.07 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.264 -179.135 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . 0.658 ' N ' ' O ' ' A' ' 70' ' ' LEU . . . 105.97 83.57 1.65 Allowed Glycine 0 CA--C 1.519 0.33 0 N-CA-C 110.54 -1.024 . . . . 0.0 110.54 -179.249 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 14.7 tp -125.64 -14.63 6.24 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.953 0.406 . . . . 0.0 110.549 -179.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.9 ' CG2' HD22 ' A' ' 70' ' ' LEU . 3.3 m -142.71 172.53 8.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.399 -179.763 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.449 HG23 ' HA ' ' A' ' 90' ' ' TYR . 24.6 t -137.62 150.93 25.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.577 178.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -128.58 146.92 17.26 Favored Glycine 0 CA--C 1.523 0.578 0 N-CA-C 110.446 -1.062 . . . . 0.0 110.446 179.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 . . . . . 0 N--CA 1.466 0.351 0 CA-C-O 120.774 0.321 . . . . 0.0 110.435 -179.852 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 64.8 t . . . . . 0 C--O 1.227 -0.128 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 94.3 m-85 -100.23 130.88 46.41 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.672 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 35.2 p -150.56 169.85 20.53 Favored 'General case' 0 C--O 1.223 -0.301 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 179.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 1.056 HD22 ' H ' ' A' ' 89' ' ' LEU . 0.6 OUTLIER -63.74 150.87 43.54 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.661 -179.626 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.466 ' N ' ' HA ' ' A' ' 76' ' ' VAL . 28.4 t80 -51.4 -48.9 62.47 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.244 -178.576 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.531 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 16.0 p-10 -153.05 -178.78 7.15 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.735 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 2.2 m -73.65 -3.26 27.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.422 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 8.5 t-160 -54.01 -74.85 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.062 0.458 . . . . 0.0 110.531 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 11.6 p -57.49 -33.81 45.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.324 -179.521 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.06 -47.67 84.9 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.633 179.694 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.44 ' O ' ' OE2' ' A' ' 100' ' ' GLU . 59.7 tt0 -63.87 -46.52 84.59 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.393 -179.749 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.448 ' CD1' ' HB2' ' B' ' 220' ' ' ALA . 13.8 tp -56.74 -45.7 81.83 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.221 -179.325 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 85.7 mt -63.32 -41.0 98.87 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.38 179.204 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -52.16 -45.04 64.91 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.41 -179.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.44 ' OE2' ' O ' ' A' ' 96' ' ' GLN . 0.9 OUTLIER -69.74 -50.46 43.27 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.666 -0.413 . . . . 0.0 110.903 179.782 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . 0.408 ' HB2' ' CD1' ' B' ' 216' ' ' LEU . . . -57.92 -53.55 56.91 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.923 -178.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.439 ' N ' ' CD1' ' A' ' 102' ' ' ILE . 1.2 mp -61.74 -44.93 99.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.617 -179.688 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 78.3 t80 -61.23 -50.61 72.39 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 120.492 -0.483 . . . . 0.0 110.804 -179.024 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' HIS . . . . . 0.41 ' CB ' ' CD2' ' B' ' 212' ' ' HIS . 68.7 m-70 -63.29 -36.96 85.4 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.615 -179.654 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 6.2 t -72.07 -46.14 58.04 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.93 179.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 81.7 tt0 -60.4 -24.43 65.14 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.187 -179.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 12.2 t-80 . . . . . 0 C--N 1.33 -0.246 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.645 179.588 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 . . . . . 0 C--O 1.236 0.365 0 CA-C-O 121.194 0.521 . . . . 0.0 111.179 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 42.0 m -52.34 -35.76 51.74 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.435 -179.324 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 10.7 tt0 -66.86 -48.93 67.3 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.625 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 138' ' ' ALA . . . . . 0.645 ' O ' HG23 ' B' ' 142' ' ' VAL . . . -55.35 -35.57 65.36 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 -179.825 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -67.19 -52.83 36.5 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.946 0.403 . . . . 0.0 110.433 179.33 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -58.13 -48.99 78.53 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.749 179.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 87.1 mt-30 -56.4 -51.09 69.63 Favored 'General case' 0 C--O 1.241 0.608 0 CA-C-O 121.303 0.573 . . . . 0.0 110.779 -179.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 142' ' ' VAL . . . . . 0.645 HG23 ' O ' ' B' ' 138' ' ' ALA . 93.5 t -60.47 -45.0 97.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.688 179.615 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 143' ' ' ALA . . . . . 0.405 ' HB2' HD12 ' A' ' 36' ' ' LEU . . . -49.84 -46.02 50.91 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.467 179.536 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 14.9 t -58.84 -45.89 88.99 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.207 -0.451 . . . . 0.0 109.933 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 22.9 m -64.61 -51.22 63.8 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 121.121 0.486 . . . . 0.0 110.915 179.244 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 146' ' ' LEU . . . . . 0.544 HD13 ' CD1' ' A' ' 27' ' ' LEU . 4.1 mm? -61.63 -26.7 68.16 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.718 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 147' ' ' GLN . . . . . 0.493 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 55.3 tt0 -75.01 -54.31 7.4 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.847 179.611 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -58.06 -55.9 28.92 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.754 -179.203 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.518 ' O ' ' O ' ' B' ' 150' ' ' ALA . 8.6 mp -45.55 -35.17 3.74 Favored 'General case' 0 CA--C 1.513 -0.479 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.264 -179.228 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 150' ' ' ALA . . . . . 0.518 ' O ' ' O ' ' B' ' 149' ' ' LEU . . . -56.79 -140.7 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.114 0.483 . . . . 0.0 110.434 179.32 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 151' ' ' THR . . . . . . . . . . . . . 84.5 m 59.54 109.38 0.03 OUTLIER Pre-proline 0 C--N 1.324 -0.536 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.336 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -50.46 -54.54 5.28 Favored 'Trans proline' 0 N--CA 1.497 1.689 0 C-N-CA 122.407 2.071 . . . . 0.0 113.066 -179.238 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 52.4 m -53.21 -45.7 68.74 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.953 -178.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 37.7 ttm180 -62.54 -44.28 96.74 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.749 -179.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 155' ' ' LEU . . . . . 0.441 HD12 ' HB2' ' A' ' 24' ' ' ALA . 8.6 mt -62.37 -46.72 87.38 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.831 -0.347 . . . . 0.0 110.918 -179.604 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 156' ' ' MET . . . . . 0.484 ' O ' ' OG1' ' B' ' 159' ' ' THR . 46.6 ttp -55.45 -49.07 73.43 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.298 0.571 . . . . 0.0 110.206 179.623 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 97.0 mt -64.62 -42.84 96.23 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 0 CA-C-O 121.276 0.56 . . . . 0.0 110.258 179.404 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 7.6 tp -62.1 -41.61 98.39 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.7 -179.257 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 159' ' ' THR . . . . . 0.484 ' OG1' ' O ' ' B' ' 156' ' ' MET . 16.9 p -60.67 -38.13 83.88 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.459 . . . . 0.0 109.956 179.85 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 87.1 mt-30 -61.75 -46.27 90.33 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.067 178.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 161' ' ' LEU . . . . . 0.414 HD23 ' HA ' ' B' ' 161' ' ' LEU . 90.4 mt -63.59 -38.72 92.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.713 179.267 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 162' ' ' ARG . . . . . 0.471 ' O ' ' ND2' ' B' ' 163' ' ' ASN . 73.7 ttp85 -50.23 -41.0 49.22 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.505 -179.425 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 163' ' ' ASN . . . . . 0.471 ' ND2' ' O ' ' B' ' 162' ' ' ARG . 16.0 m120 -138.4 49.83 1.9 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.376 179.736 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . -175.87 76.89 0.08 OUTLIER Glycine 0 CA--C 1.528 0.887 0 N-CA-C 111.119 -0.792 . . . . 0.0 111.119 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -77.43 114.34 3.71 Favored 'Trans proline' 0 N--CA 1.494 1.535 0 C-N-CA 122.8 2.333 . . . . 0.0 111.593 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 166' ' ' LEU . . . . . 0.492 ' O ' HD12 ' B' ' 166' ' ' LEU . 0.3 OUTLIER -160.36 157.37 24.32 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.656 -178.926 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -65.17 176.69 2.99 Favored 'Trans proline' 0 C--N 1.308 -1.595 0 C-N-CA 122.817 2.345 . . . . 0.0 111.753 179.006 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 168' ' ' VAL . . . . . 0.542 HG23 ' N ' ' B' ' 169' ' ' THR . 3.8 m -63.22 -43.47 98.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 121.522 0.677 . . . . 0.0 111.306 -179.718 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 169' ' ' THR . . . . . 0.542 ' N ' HG23 ' B' ' 168' ' ' VAL . 52.3 p -57.21 -66.65 0.42 Allowed 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.639 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 92.9 m-20 -50.02 -38.69 38.7 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 -179.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 171' ' ' LEU . . . . . 0.711 HD23 ' O ' ' B' ' 171' ' ' LEU . 5.0 tt -59.43 -41.91 90.64 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.59 -0.444 . . . . 0.0 109.999 179.531 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 172' ' ' ALA . . . . . 0.598 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -67.66 -43.19 80.84 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.55 -0.296 . . . . 0.0 110.306 179.386 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 85.3 tt0 -53.33 -42.36 66.65 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.054 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -62.83 -40.87 98.76 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.4 179.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 96.5 mt -87.87 -68.31 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.314 179.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 176' ' ' GLY . . . . . 0.598 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 144.75 72.75 0.02 OUTLIER Glycine 0 CA--C 1.524 0.62 0 N-CA-C 111.078 -0.809 . . . . 0.0 111.078 179.531 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 3.1 tmm? 67.26 97.95 0.05 Allowed 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.673 -0.411 . . . . 0.0 110.591 179.593 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -173.07 22.46 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.204 0.526 . . . . 0.0 110.431 179.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -69.15 -24.75 64.12 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.037 0.446 . . . . 0.0 110.384 -179.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 12.1 t -65.71 -43.65 88.47 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 121.182 0.515 . . . . 0.0 110.503 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -60.85 -32.41 71.82 Favored 'General case' 0 C--O 1.239 0.53 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.089 179.575 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 182' ' ' VAL . . . . . 0.407 ' O ' ' HG ' ' B' ' 186' ' ' LEU . 94.5 t -67.21 -50.56 62.05 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.375 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.102 179.544 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 70.0 m -53.02 -41.94 65.18 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 121.029 0.442 . . . . 0.0 110.129 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -58.59 -42.22 87.58 Favored 'General case' 0 C--O 1.242 0.676 0 CA-C-O 121.406 0.622 . . . . 0.0 109.788 178.634 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 58.4 tt0 -60.09 -38.67 83.63 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.087 179.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 186' ' ' LEU . . . . . 0.69 ' HA ' HD23 ' B' ' 189' ' ' LEU . 22.1 mt -62.24 -42.71 99.56 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-O 120.922 0.392 . . . . 0.0 110.52 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -54.95 -47.19 74.82 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.681 179.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 97.0 t -67.79 -48.85 74.11 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.106 0 C-N-CA 120.427 -0.509 . . . . 0.0 110.255 178.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 189' ' ' LEU . . . . . 0.901 HD22 ' CG2' ' B' ' 195' ' ' VAL . 0.1 OUTLIER -49.58 -45.4 47.76 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 -179.146 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 190' ' ' ARG . . . . . 0.63 ' N ' ' HG ' ' B' ' 189' ' ' LEU . 90.3 mtt-85 -61.81 -43.21 99.31 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.727 -0.67 . . . . 0.0 109.716 -178.485 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 191' ' ' ASN . . . . . 0.443 ' C ' HD22 ' B' ' 192' ' ' LEU . 99.3 m-20 -66.07 -41.07 91.26 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.937 179.153 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 192' ' ' LEU . . . . . 0.543 ' N ' HD22 ' B' ' 192' ' ' LEU . 4.0 mm? -95.8 -61.63 1.42 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.306 -178.862 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 193' ' ' GLY . . . . . 0.686 ' N ' ' O ' ' B' ' 189' ' ' LEU . . . 103.05 82.47 1.63 Allowed Glycine 0 CA--C 1.52 0.349 0 N-CA-C 110.462 -1.055 . . . . 0.0 110.462 -179.42 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 15.6 tp -124.68 -15.0 6.66 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-O 120.951 0.405 . . . . 0.0 110.743 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 195' ' ' VAL . . . . . 0.901 ' CG2' HD22 ' B' ' 189' ' ' LEU . 3.0 m -142.2 171.91 9.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.376 -179.724 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 196' ' ' VAL . . . . . 0.448 HG23 ' HA ' ' B' ' 209' ' ' TYR . 24.7 t -137.76 152.17 26.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.473 178.745 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 197' ' ' GLY . . . . . . . . . . . . . . . -130.68 148.36 18.7 Favored Glycine 0 CA--C 1.522 0.494 0 N-CA-C 110.54 -1.024 . . . . 0.0 110.54 179.23 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 89.1 m-20 . . . . . 0 C--O 1.236 0.355 0 CA-C-O 120.803 0.335 . . . . 0.0 110.621 -179.784 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 71.2 t . . . . . 0 C--O 1.226 -0.154 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -101.27 130.76 47.46 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.675 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 18.0 p -151.13 170.3 19.77 Favored 'General case' 0 C--O 1.223 -0.339 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 208' ' ' LEU . . . . . 1.044 HD22 ' H ' ' B' ' 208' ' ' LEU . 0.5 OUTLIER -63.41 152.07 39.23 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.653 -179.583 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 209' ' ' TYR . . . . . 0.478 ' N ' ' HA ' ' B' ' 195' ' ' VAL . 29.0 t80 -53.96 -48.38 70.37 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.234 -178.578 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 210' ' ' ASP . . . . . 0.531 ' N ' ' OD1' ' B' ' 210' ' ' ASP . 16.3 p-10 -151.56 179.8 8.06 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.74 179.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 2.5 m -74.19 -1.81 22.01 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.473 -179.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 212' ' ' HIS . . . . . 0.41 ' CD2' ' CB ' ' A' ' 104' ' ' HIS . 9.0 t-160 -56.04 -73.63 0.06 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.992 0.425 . . . . 0.0 110.46 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 9.6 p -57.54 -33.02 43.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.319 -179.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 214' ' ' ALA . . . . . . . . . . . . . . . -61.34 -47.96 83.52 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.637 179.699 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 215' ' ' GLN . . . . . 0.443 ' O ' ' OE1' ' B' ' 219' ' ' GLU . 59.4 tt0 -63.69 -46.28 86.23 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.338 -179.698 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 216' ' ' LEU . . . . . 0.408 ' CD1' ' HB2' ' A' ' 101' ' ' ALA . 14.5 tp -56.58 -46.11 80.98 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.217 -179.262 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 86.0 mt -63.53 -39.63 94.92 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.281 179.284 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -52.79 -45.44 67.17 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.4 -179.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 219' ' ' GLU . . . . . 0.443 ' OE1' ' O ' ' B' ' 215' ' ' GLN . 1.1 mp0 -70.44 -48.53 55.49 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.98 179.761 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 220' ' ' ALA . . . . . 0.448 ' HB2' ' CD1' ' A' ' 97' ' ' LEU . . . -59.21 -53.4 58.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.046 -179.003 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 221' ' ' ILE . . . . . 0.437 ' N ' ' CD1' ' B' ' 221' ' ' ILE . 1.2 mp -62.27 -44.82 99.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.663 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 75.9 t80 -61.07 -49.9 75.46 Favored 'General case' 0 C--N 1.32 -0.691 0 C-N-CA 120.475 -0.49 . . . . 0.0 110.747 -179.088 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 223' ' ' HIS . . . . . . . . . . . . . 56.4 m-70 -64.06 -37.18 86.49 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.727 -179.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 9.1 t -71.69 -45.99 60.16 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.915 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -60.71 -23.63 65.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.369 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 9.8 t-80 . . . . . 0 C--N 1.331 -0.22 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.615 179.511 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 . . . . . 0 N--CA 1.465 0.314 0 CA-C-O 121.12 0.486 . . . . 0.0 110.768 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 46.0 m -59.18 -33.35 70.84 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.228 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -67.56 -49.15 64.57 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.496 179.69 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -57.95 -36.07 72.02 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.927 -0.309 . . . . 0.0 110.289 -179.826 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.71 -53.52 26.9 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 120.884 0.373 . . . . 0.0 110.492 179.637 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.08 -42.07 99.55 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.912 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 16.5 mm100 -61.32 -52.9 62.75 Favored 'General case' 0 C--O 1.239 0.509 0 CA-C-O 121.304 0.573 . . . . 0.0 110.644 -179.603 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 74.4 t -62.19 -47.09 94.75 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.854 179.589 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -53.13 -42.81 66.4 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 120.809 -0.356 . . . . 0.0 110.252 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 50.0 m -59.55 -43.39 93.56 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.332 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 17.6 m -64.42 -51.98 60.47 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 120.449 -0.5 . . . . 0.0 110.725 179.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.445 ' N ' ' CD1' ' A' ' 27' ' ' LEU . 7.9 mp -66.16 -20.02 66.01 Favored 'General case' 0 CA--C 1.513 -0.457 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.615 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.445 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 54.1 tt0 -74.01 -63.44 1.22 Allowed 'General case' 0 C--N 1.32 -0.687 0 O-C-N 123.418 0.449 . . . . 0.0 110.842 179.697 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -57.47 -51.96 67.32 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.939 -179.191 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.437 ' O ' ' C ' ' A' ' 31' ' ' ALA . 4.1 mm? -54.52 -39.15 67.35 Favored 'General case' 0 CA--C 1.508 -0.645 0 C-N-CA 120.876 -0.329 . . . . 0.0 110.279 -178.851 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.555 ' O ' ' C ' ' A' ' 32' ' ' THR . . . -37.67 -69.31 0.12 Allowed 'General case' 0 CA--C 1.511 -0.549 0 O-C-N 123.531 0.519 . . . . 0.0 110.062 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.555 ' C ' ' O ' ' A' ' 31' ' ' ALA . 15.9 m -5.57 111.57 0.03 OUTLIER Pre-proline 0 CA--C 1.54 0.595 0 O-C-N 124.851 1.344 . . . . 0.0 111.124 -179.334 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_exo -45.75 -42.9 19.39 Favored 'Trans proline' 0 C--N 1.309 -1.511 0 C-N-CA 122.246 1.964 . . . . 0.0 112.652 -178.008 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 67.5 m -57.66 -46.69 83.9 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.609 -179.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -67.06 -36.85 82.93 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.053 0.454 . . . . 0.0 110.179 179.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.465 HD13 ' O ' ' A' ' 36' ' ' LEU . 0.2 OUTLIER -59.2 -52.85 63.91 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 120.097 -0.641 . . . . 0.0 110.725 -178.047 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 64.2 ttp -62.74 -44.48 96.1 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.938 179.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 89.3 mt -60.26 -44.56 95.89 Favored 'Isoleucine or valine' 0 C--O 1.242 0.678 0 CA-C-O 121.584 0.707 . . . . 0.0 110.685 -178.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -63.84 -39.0 93.18 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.632 179.639 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 14.9 m -59.02 -39.32 81.57 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.797 179.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -62.31 -44.77 95.73 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.235 179.627 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.449 ' O ' ' N ' ' A' ' 45' ' ' GLY . 23.6 mt -62.51 -43.12 99.58 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 120.504 -0.478 . . . . 0.0 111.293 179.686 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.504 HH21 ' CG ' ' A' ' 99' ' ' ASP . 79.3 ttt-85 -40.14 -31.12 0.11 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.685 -179.703 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 78.3 m-20 -60.07 -42.3 94.25 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.267 -179.497 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.449 ' N ' ' O ' ' A' ' 42' ' ' LEU . . . 126.29 -116.08 2.46 Favored Glycine 0 CA--C 1.535 1.339 0 N-CA-C 111.384 -0.686 . . . . 0.0 111.384 179.204 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -73.95 128.83 12.7 Favored 'Trans proline' 0 N--CA 1.495 1.609 0 C-N-CA 122.271 1.981 . . . . 0.0 112.434 -179.153 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -176.33 86.46 0.27 Allowed Pre-proline 0 C--N 1.327 -0.407 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.445 179.443 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -49.35 171.12 0.08 OUTLIER 'Trans proline' 0 C--N 1.306 -1.688 0 C-N-CA 122.742 2.294 . . . . 0.0 112.281 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 70.4 t -55.4 -44.28 75.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.25 -179.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 19.0 m -61.75 -44.32 97.12 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.284 179.207 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 66.2 t0 -63.94 -40.35 96.25 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-O 121.383 0.611 . . . . 0.0 110.296 179.692 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.616 HD23 ' O ' ' A' ' 52' ' ' LEU . 5.1 tt -61.31 -44.19 97.62 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.778 -0.646 . . . . 0.0 109.831 -179.741 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.579 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -59.21 -43.73 92.27 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 179.543 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 84.7 tt0 -54.56 -47.05 73.72 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.068 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -57.89 -49.98 74.87 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.546 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.455 HD12 ' CD2' ' A' ' 52' ' ' LEU . 96.8 mt -85.36 -73.76 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.522 -0.126 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.238 179.688 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . 0.579 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 131.74 77.37 0.14 Allowed Glycine 0 N--CA 1.461 0.331 0 N-CA-C 111.472 -0.651 . . . . 0.0 111.472 179.218 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.473 ' CB ' ' O ' ' A' ' 57' ' ' GLY . 23.2 ttm 80.93 99.26 0.06 Allowed 'General case' 0 C--O 1.234 0.239 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.955 178.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 179.32 22.18 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.165 179.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 55.3 mt-30 -56.92 -27.82 61.34 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 120.825 0.345 . . . . 0.0 111.135 -179.145 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 45.7 m -70.04 -45.83 66.33 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 120.931 0.396 . . . . 0.0 111.212 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.26 -29.3 70.65 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.116 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 70.0 t -72.66 -52.21 24.25 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.246 0 C-N-CA 120.546 -0.461 . . . . 0.0 110.596 179.751 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 11.1 t -55.2 -43.37 74.34 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.303 -0.559 . . . . 0.0 110.558 -179.383 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 60.0 t-80 -69.62 -49.45 53.81 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.364 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 70.1 tp60 -58.98 -45.35 90.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.58 -179.231 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.401 ' O ' ' CG ' ' A' ' 71' ' ' ARG . 3.1 mm? -63.63 -40.11 96.06 Favored 'General case' 0 CA--C 1.502 -0.878 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.479 -179.885 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 72.1 ttt180 -58.24 -43.63 87.89 Favored 'General case' 0 C--N 1.303 -1.414 0 C-N-CA 120.016 -0.673 . . . . 0.0 110.099 179.364 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 91.9 t -67.84 -53.83 27.52 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.385 179.692 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.599 ' O ' ' N ' ' A' ' 74' ' ' GLY . 94.2 mt -57.93 -38.38 75.83 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-N 116.151 -0.477 . . . . 0.0 109.807 -179.507 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.401 ' CG ' ' O ' ' A' ' 67' ' ' LEU . 11.0 mmm180 -59.93 -43.42 94.95 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.139 179.658 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.42 ' CB ' HD23 ' A' ' 73' ' ' LEU . 88.1 m-20 -64.88 -43.44 92.92 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 120.466 -0.494 . . . . 0.0 110.314 179.78 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.42 HD23 ' CB ' ' A' ' 72' ' ' ASN . 0.4 OUTLIER -153.93 73.02 0.92 Allowed 'General case' 0 C--N 1.334 -0.067 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.755 179.28 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . 0.599 ' N ' ' O ' ' A' ' 70' ' ' LEU . . . -147.2 1.05 0.73 Allowed Glycine 0 N--CA 1.464 0.564 0 N-CA-C 110.882 -0.887 . . . . 0.0 110.882 -179.738 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.577 HD22 ' N ' ' A' ' 75' ' ' LEU . 3.8 mm? 55.43 61.25 2.95 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.849 0.357 . . . . 0.0 110.994 179.523 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 34.0 m -132.52 156.25 42.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.193 179.217 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.727 HG12 ' N ' ' A' ' 78' ' ' GLY . 60.3 t -131.83 174.04 13.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.239 -179.651 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . 0.727 ' N ' HG12 ' A' ' 77' ' ' VAL . . . -165.29 159.21 32.32 Favored Glycine 0 CA--C 1.526 0.739 0 N-CA-C 110.519 -1.032 . . . . 0.0 110.519 179.07 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 . . . . . 0 N--CA 1.47 0.544 0 CA-C-O 120.753 0.311 . . . . 0.0 110.697 -179.89 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 72.8 t . . . . . 0 CA--C 1.521 -0.166 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 99.7 m-85 -106.35 130.44 54.18 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.621 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 66.9 m -150.5 171.04 17.7 Favored 'General case' 0 C--N 1.341 0.2 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 49.4 mt -79.24 146.82 32.82 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.56 -179.707 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 6.0 t80 -56.08 -48.06 76.8 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.654 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 75.6 m-20 -125.47 176.39 6.85 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 116.433 -0.348 . . . . 0.0 110.291 -179.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 22.3 p -99.8 -1.84 36.57 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.323 -179.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . 0.572 ' CE1' ' CD2' ' B' ' 223' ' ' HIS . 60.8 m80 -53.61 -55.33 26.77 Favored 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 120.855 -0.338 . . . . 0.0 110.376 -179.817 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.491 ' HA ' HD21 ' A' ' 97' ' ' LEU . 61.4 t -44.5 -39.01 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.047 0.451 . . . . 0.0 110.322 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -71.68 -36.5 70.64 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.939 179.555 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 96.2 mm-40 -64.3 -53.28 51.44 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.188 0.518 . . . . 0.0 111.285 -178.719 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.491 HD21 ' HA ' ' A' ' 94' ' ' VAL . 3.2 pp -67.94 -39.93 83.39 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.557 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.447 ' N ' HD12 ' A' ' 97' ' ' LEU . 6.4 tt -65.36 -41.37 93.88 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.226 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . 0.504 ' CG ' HH21 ' A' ' 43' ' ' ARG . 78.4 m-20 -61.86 -38.35 87.93 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.845 -179.646 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.424 ' OE2' ' OE2' ' B' ' 219' ' ' GLU . 97.9 mt-10 -71.67 -44.68 63.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.847 179.308 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -63.06 -49.83 72.99 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.57 -179.637 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.425 HD13 ' HG ' ' A' ' 98' ' ' LEU . 1.2 mp -63.77 -43.83 98.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.875 178.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 89.2 t80 -60.02 -47.82 84.26 Favored 'General case' 0 C--N 1.313 -0.991 0 C-N-CA 120.626 -0.43 . . . . 0.0 110.831 -179.26 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' HIS . . . . . 0.519 ' CD2' ' CE1' ' B' ' 212' ' ' HIS . 11.7 t-160 -66.65 -35.98 81.47 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.124 179.765 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 4.4 t -73.3 -49.61 26.64 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.002 0.43 . . . . 0.0 111.487 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -67.28 -21.18 65.71 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.626 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 19.8 t60 . . . . . 0 N--CA 1.452 -0.326 0 C-N-CA 120.694 -0.403 . . . . 0.0 110.426 -179.277 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 92.8 m-20 . . . . . 0 C--O 1.235 0.312 0 CA-C-O 121.222 0.534 . . . . 0.0 110.722 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 65.0 m -59.85 -33.04 71.26 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.323 179.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 -67.88 -49.52 61.55 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.467 179.741 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 138' ' ' ALA . . . . . 0.456 ' O ' HG23 ' B' ' 142' ' ' VAL . . . -57.49 -35.63 70.45 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.89 -0.324 . . . . 0.0 110.287 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -67.54 -53.35 29.14 Favored 'General case' 0 CA--C 1.528 0.133 0 C-N-CA 120.759 -0.377 . . . . 0.0 110.534 179.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -63.06 -41.31 99.42 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.872 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 19.6 mm100 -62.08 -52.86 62.21 Favored 'General case' 0 C--O 1.239 0.542 0 CA-C-O 121.068 0.461 . . . . 0.0 110.603 -179.571 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 142' ' ' VAL . . . . . 0.456 HG23 ' O ' ' B' ' 138' ' ' ALA . 84.2 t -62.28 -46.96 95.22 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 179.598 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -53.17 -43.11 66.83 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.193 179.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 69.3 m -59.17 -44.45 92.16 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.426 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 21.6 m -64.52 -51.5 62.6 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.715 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 146' ' ' LEU . . . . . 0.418 ' N ' ' CD1' ' B' ' 146' ' ' LEU . 8.3 mp -66.09 -20.16 66.07 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.681 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 147' ' ' GLN . . . . . 0.471 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 58.3 tt0 -74.62 -62.93 1.36 Allowed 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.889 179.818 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -57.91 -52.55 65.01 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.138 -179.12 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.427 ' O ' ' C ' ' B' ' 150' ' ' ALA . 4.2 mm? -53.78 -37.57 63.58 Favored 'General case' 0 CA--C 1.508 -0.665 0 C-N-CA 120.794 -0.362 . . . . 0.0 110.194 -178.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 150' ' ' ALA . . . . . 0.552 ' O ' ' C ' ' B' ' 151' ' ' THR . . . -39.31 -70.16 0.11 Allowed 'General case' 0 CA--C 1.511 -0.543 0 O-C-N 123.483 0.49 . . . . 0.0 110.136 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 151' ' ' THR . . . . . 0.552 ' C ' ' O ' ' B' ' 150' ' ' ALA . 11.2 m -5.19 111.43 0.03 OUTLIER Pre-proline 0 N--CA 1.471 0.624 0 O-C-N 124.827 1.329 . . . . 0.0 111.07 -179.301 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -45.55 -42.43 18.46 Favored 'Trans proline' 0 C--N 1.307 -1.634 0 C-N-CA 122.26 1.973 . . . . 0.0 112.686 -177.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 73.0 m -58.02 -45.89 86.18 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.53 -179.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 92.9 mtt180 -68.17 -37.08 80.6 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.191 0.519 . . . . 0.0 110.251 179.55 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 155' ' ' LEU . . . . . 0.473 ' O ' HD13 ' B' ' 155' ' ' LEU . 0.2 OUTLIER -59.86 -52.88 63.55 Favored 'General case' 0 C--N 1.32 -0.703 0 C-N-CA 120.032 -0.667 . . . . 0.0 111.009 -178.155 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 65.5 ttp -62.83 -44.13 96.96 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.706 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 80.3 mt -60.38 -44.58 96.34 Favored 'Isoleucine or valine' 0 C--O 1.241 0.636 0 CA-C-O 121.478 0.656 . . . . 0.0 110.465 -179.144 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -63.38 -39.81 95.53 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.662 179.335 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 25.0 m -57.94 -39.89 79.16 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.725 179.594 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 98.9 mm-40 -61.71 -45.1 95.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.236 179.721 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 161' ' ' LEU . . . . . 0.431 ' O ' ' N ' ' B' ' 164' ' ' GLY . 21.8 mt -62.8 -43.13 99.62 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 120.442 -0.503 . . . . 0.0 111.256 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 162' ' ' ARG . . . . . 0.501 HH21 ' CG ' ' B' ' 218' ' ' ASP . 78.9 ttt-85 -40.46 -30.15 0.1 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.736 -179.834 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 82.3 m-20 -60.48 -42.66 96.71 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.293 -179.333 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 164' ' ' GLY . . . . . 0.431 ' N ' ' O ' ' B' ' 161' ' ' LEU . . . 127.57 -114.89 2.0 Favored Glycine 0 CA--C 1.538 1.469 0 N-CA-C 111.191 -0.764 . . . . 0.0 111.191 179.252 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -75.8 129.09 11.34 Favored 'Trans proline' 0 N--CA 1.494 1.552 0 C-N-CA 122.4 2.067 . . . . 0.0 112.331 -179.537 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -175.91 84.14 0.29 Allowed Pre-proline 0 C--N 1.327 -0.394 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.242 179.457 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 55.1 Cg_exo -48.1 171.79 0.05 OUTLIER 'Trans proline' 0 C--N 1.305 -1.72 0 C-N-CA 122.756 2.304 . . . . 0.0 112.3 -179.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . 72.3 t -55.26 -44.96 77.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.317 -179.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 169' ' ' THR . . . . . . . . . . . . . 13.2 m -62.36 -44.46 96.42 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.367 179.18 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 64.3 t0 -63.3 -39.92 95.9 Favored 'General case' 0 C--O 1.24 0.553 0 CA-C-O 121.433 0.635 . . . . 0.0 110.162 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 171' ' ' LEU . . . . . 0.61 HD23 ' O ' ' B' ' 171' ' ' LEU . 4.5 tt -62.12 -43.91 97.81 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.81 -179.665 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 172' ' ' ALA . . . . . 0.577 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -59.42 -43.94 92.98 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 179.717 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 82.2 tt0 -54.46 -46.78 73.38 Favored 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 120.615 -0.434 . . . . 0.0 109.996 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -58.7 -50.76 72.7 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 120.683 -0.407 . . . . 0.0 110.693 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 93.8 mt -83.97 -73.53 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.102 179.617 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 176' ' ' GLY . . . . . 0.577 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 131.34 77.9 0.16 Allowed Glycine 0 C--N 1.332 0.309 0 N-CA-C 111.567 -0.613 . . . . 0.0 111.567 179.429 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 177' ' ' MET . . . . . 0.456 ' CB ' ' O ' ' B' ' 176' ' ' GLY . 23.9 ttm 79.94 99.39 0.06 Allowed 'General case' 0 C--O 1.233 0.229 0 C-N-CA 120.801 -0.36 . . . . 0.0 111.01 178.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 178' ' ' GLU . . . . . 0.424 ' OE1' ' O ' ' B' ' 177' ' ' MET . 1.3 tp10 179.45 22.97 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.18 179.632 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 51.2 mt-30 -57.82 -27.12 62.88 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 120.897 0.38 . . . . 0.0 111.027 -179.124 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 69.6 m -70.41 -45.99 64.84 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.159 179.844 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -63.47 -29.28 70.59 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.119 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 84.4 t -72.51 -52.41 23.67 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.305 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.45 179.669 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 9.5 t -55.12 -43.13 73.8 Favored 'General case' 0 C--N 1.32 -0.701 0 C-N-CA 120.282 -0.567 . . . . 0.0 110.614 -179.52 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 -69.98 -49.63 49.78 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.329 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 68.4 tp60 -59.02 -45.34 90.96 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.016 0.436 . . . . 0.0 110.652 -179.195 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -63.57 -40.36 96.77 Favored 'General case' 0 CA--C 1.502 -0.893 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.32 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 72.9 ttt180 -58.43 -43.75 88.86 Favored 'General case' 0 C--N 1.304 -1.394 0 C-N-CA 120.08 -0.648 . . . . 0.0 110.242 179.41 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 84.0 t -67.49 -53.5 31.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.169 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.102 179.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 189' ' ' LEU . . . . . 0.589 ' O ' ' N ' ' B' ' 193' ' ' GLY . 94.6 mt -57.73 -38.45 75.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.27 0.557 . . . . 0.0 109.741 -179.513 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 8.9 mmm180 -59.72 -44.13 93.87 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.302 179.72 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 191' ' ' ASN . . . . . 0.443 ' CB ' HD23 ' B' ' 192' ' ' LEU . 87.8 m-20 -64.42 -42.86 95.81 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.424 -0.51 . . . . 0.0 110.261 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 192' ' ' LEU . . . . . 0.443 HD23 ' CB ' ' B' ' 191' ' ' ASN . 0.4 OUTLIER -154.78 74.56 0.94 Allowed 'General case' 0 C--O 1.23 0.065 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.692 179.292 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 193' ' ' GLY . . . . . 0.589 ' N ' ' O ' ' B' ' 189' ' ' LEU . . . -148.38 0.73 0.59 Allowed Glycine 0 N--CA 1.463 0.471 0 N-CA-C 110.921 -0.872 . . . . 0.0 110.921 -179.648 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 194' ' ' LEU . . . . . 0.602 HD22 ' N ' ' B' ' 194' ' ' LEU . 3.7 mm? 56.28 60.44 3.16 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.814 0.34 . . . . 0.0 110.869 179.585 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 34.4 m -131.82 154.72 40.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.205 179.232 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 196' ' ' VAL . . . . . 0.468 HG12 ' N ' ' B' ' 197' ' ' GLY . 54.0 t -136.61 155.9 34.61 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.28 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.541 -179.379 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 197' ' ' GLY . . . . . 0.468 ' N ' HG12 ' B' ' 196' ' ' VAL . . . -145.67 158.74 27.76 Favored Glycine 0 CA--C 1.521 0.426 0 N-CA-C 110.341 -1.103 . . . . 0.0 110.341 179.718 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 . . . . . 0 N--CA 1.469 0.505 0 CA-C-O 120.941 0.4 . . . . 0.0 110.677 -179.807 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 83.2 t . . . . . 0 C--O 1.225 -0.197 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 98.9 m-85 -105.45 130.66 53.48 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.557 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 69.9 m -150.82 171.52 17.09 Favored 'General case' 0 C--O 1.227 -0.12 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . 41.1 mt -79.04 147.44 32.84 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.535 -179.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 209' ' ' TYR . . . . . 0.435 ' CD2' ' CG2' ' B' ' 196' ' ' VAL . 5.9 t80 -55.66 -48.48 74.96 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.715 -0.394 . . . . 0.0 110.348 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 80.4 m-20 -124.74 -178.54 4.18 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 -179.716 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 66.6 p -104.02 -2.68 25.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.362 -179.771 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 212' ' ' HIS . . . . . 0.519 ' CE1' ' CD2' ' A' ' 104' ' ' HIS . 65.5 m80 -52.62 -54.98 25.73 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.332 -179.769 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 213' ' ' VAL . . . . . 0.509 ' HA ' HD21 ' B' ' 216' ' ' LEU . 10.6 t -44.67 -40.01 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 121.039 0.447 . . . . 0.0 110.282 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 214' ' ' ALA . . . . . . . . . . . . . . . -71.61 -36.75 70.89 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.906 179.547 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 97.5 mm-40 -64.24 -53.76 43.99 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.227 0.537 . . . . 0.0 111.223 -178.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 216' ' ' LEU . . . . . 0.509 HD21 ' HA ' ' B' ' 213' ' ' VAL . 3.1 pp -67.29 -40.08 86.07 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.621 -179.846 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 217' ' ' LEU . . . . . 0.453 ' HG ' HD13 ' B' ' 221' ' ' ILE . 6.3 tt -65.05 -42.33 94.35 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.467 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 218' ' ' ASP . . . . . 0.501 ' CG ' HH21 ' B' ' 162' ' ' ARG . 93.5 m-20 -61.13 -37.9 84.47 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.027 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 219' ' ' GLU . . . . . 0.424 ' OE2' ' OE2' ' A' ' 100' ' ' GLU . 97.2 mt-10 -71.79 -42.59 66.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.854 179.194 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -65.71 -49.37 68.73 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.006 0.432 . . . . 0.0 110.642 -179.747 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 221' ' ' ILE . . . . . 0.453 HD13 ' HG ' ' B' ' 217' ' ' LEU . 1.3 mp -63.99 -43.02 97.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.331 179.613 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 89.1 t80 -60.37 -48.12 83.1 Favored 'General case' 0 C--N 1.314 -0.952 0 C-N-CA 120.609 -0.437 . . . . 0.0 110.939 -179.28 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 223' ' ' HIS . . . . . 0.572 ' CD2' ' CE1' ' A' ' 93' ' ' HIS . 12.0 t-160 -67.07 -35.15 79.19 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.15 179.759 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 23.3 t -74.18 -50.29 19.9 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.952 0.406 . . . . 0.0 111.336 -179.692 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 71.9 mm-40 -66.73 -22.01 66.06 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.673 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 10.5 t60 . . . . . 0 N--CA 1.453 -0.293 0 C-N-CA 120.664 -0.415 . . . . 0.0 110.487 -179.221 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . 0.43 ' O ' ' HB3' ' A' ' 19' ' ' ALA . 30.8 m-20 . . . . . 0 C--O 1.245 0.82 0 CA-C-O 121.052 0.454 . . . . 0.0 110.678 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 10.2 t -53.64 -57.71 9.79 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.387 -178.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 17.2 mp0 -44.98 -47.46 11.46 Favored 'General case' 0 C--O 1.21 -0.992 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 179.291 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.43 ' HB3' ' O ' ' A' ' 16' ' ' ASP . . . -50.58 -56.45 11.65 Favored 'General case' 0 C--O 1.242 0.664 0 C-N-CA 120.425 -0.51 . . . . 0.0 110.008 -178.49 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.17 -53.5 48.34 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.756 179.453 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -51.3 -47.64 62.53 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.778 -179.439 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 70.8 tp60 -54.48 -51.98 63.35 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-O 120.921 0.391 . . . . 0.0 110.274 -179.266 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 88.8 t -64.34 -47.53 89.22 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.53 179.779 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.04 -44.87 83.35 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.092 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 11.3 t -56.05 -42.78 77.13 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 26.3 m -60.11 -50.33 74.14 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.476 179.424 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.467 ' N ' ' CD1' ' A' ' 27' ' ' LEU . 7.2 mp -68.06 -23.21 64.93 Favored 'General case' 0 CA--C 1.522 -0.128 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.572 179.214 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.5 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 52.7 tt0 -70.89 -66.81 0.56 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.321 -179.707 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.62 -53.54 57.18 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.882 0.372 . . . . 0.0 110.438 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.503 ' O ' ' O ' ' A' ' 31' ' ' ALA . 46.3 tp -45.2 -28.41 0.77 Allowed 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.631 -179.5 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.503 ' O ' ' O ' ' A' ' 30' ' ' LEU . . . -56.22 -124.4 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.29 179.387 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.464 ' O ' ' O ' ' A' ' 31' ' ' ALA . 85.5 m 55.77 111.26 0.02 OUTLIER Pre-proline 0 C--N 1.324 -0.516 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.319 179.263 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -48.42 -47.99 18.51 Favored 'Trans proline' 0 C--N 1.305 -1.715 0 C-N-CA 122.496 2.131 . . . . 0.0 112.605 -178.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 65.1 m -62.09 -46.62 88.29 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.174 -179.058 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 53.1 ttm-85 -61.21 -45.25 95.36 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.699 -178.512 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.564 HD23 ' O ' ' A' ' 36' ' ' LEU . 1.4 tt -59.97 -52.78 63.94 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.666 -0.414 . . . . 0.0 110.343 -178.653 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 11.3 tpt -51.24 -47.79 62.29 Favored 'General case' 0 C--O 1.238 0.475 0 C-N-CA 120.63 -0.428 . . . . 0.0 110.035 -179.727 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 35.4 mm -63.34 -43.09 98.43 Favored 'Isoleucine or valine' 0 C--O 1.246 0.883 0 CA-C-O 121.101 0.477 . . . . 0.0 110.652 179.461 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.572 HD13 ' O ' ' A' ' 39' ' ' LEU . 0.2 OUTLIER -62.46 -43.7 98.19 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.758 -179.422 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 19.3 m -58.29 -40.46 82.0 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.913 179.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 60.7 tp60 -58.0 -45.55 86.67 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.113 179.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.416 HD22 ' O ' ' A' ' 87' ' ' TYR . 11.4 mt -65.42 -39.21 91.86 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.255 178.105 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 3.4 tmt_? -53.64 -46.07 70.4 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.583 -178.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 29.2 t-20 -61.44 -38.79 88.45 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.994 0.426 . . . . 0.0 110.226 179.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.401 ' O ' HD12 ' A' ' 47' ' ' LEU . . . -173.55 157.11 25.4 Favored Glycine 0 CA--C 1.527 0.8 0 N-CA-C 111.074 -0.811 . . . . 0.0 111.074 179.511 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.446 ' O ' ' O ' ' A' ' 47' ' ' LEU . 51.9 Cg_endo -71.34 -74.58 0.01 OUTLIER 'Trans proline' 0 C--N 1.31 -1.49 0 C-N-CA 122.727 2.285 . . . . 0.0 112.697 179.769 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.446 ' O ' ' O ' ' A' ' 46' ' ' PRO . 0.5 OUTLIER 59.57 144.59 0.05 OUTLIER Pre-proline 0 C--N 1.321 -0.643 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.022 178.306 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -67.54 167.28 21.25 Favored 'Trans proline' 0 C--N 1.305 -1.712 0 C-N-CA 122.554 2.169 . . . . 0.0 111.877 178.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.81 HG12 ' OE1' ' A' ' 60' ' ' GLN . 66.9 t -58.69 -41.77 83.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.131 -179.925 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.424 ' H ' HG22 ' A' ' 50' ' ' THR . 0.0 OUTLIER -60.28 -41.5 93.47 Favored 'General case' 0 C--O 1.248 0.991 0 CA-C-O 121.471 0.653 . . . . 0.0 110.69 179.78 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -64.96 -38.66 91.69 Favored 'General case' 0 C--O 1.239 0.551 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.04 179.664 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 17.9 mt -62.44 -35.23 78.63 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.342 179.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.495 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -60.96 -46.33 91.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.785 178.678 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 70.3 mm-40 -57.61 -47.95 80.75 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 120.484 -0.487 . . . . 0.0 110.28 179.751 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.14 -44.58 88.16 Favored 'General case' 0 C--O 1.232 0.166 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.447 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 97.4 mt -97.62 -80.05 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.461 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . 0.495 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 156.94 103.19 0.2 Allowed Glycine 0 CA--C 1.526 0.723 0 N-CA-C 110.767 -0.933 . . . . 0.0 110.767 -179.624 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.517 ' O ' ' NE2' ' A' ' 60' ' ' GLN . 70.2 mmm 43.3 -114.84 0.34 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.109 0.481 . . . . 0.0 110.471 179.723 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 50.33 13.17 0.11 Allowed 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.417 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.81 ' OE1' HG12 ' A' ' 49' ' ' VAL . 3.2 mm-40 -50.85 -29.59 12.21 Favored 'General case' 0 C--O 1.238 0.498 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.667 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 3.0 t -72.98 -33.88 66.11 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.298 179.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.5 -38.96 74.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.123 -178.583 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.458 HG23 ' N ' ' A' ' 64' ' ' SER . 12.5 m -71.06 -47.02 63.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.568 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.458 ' N ' HG23 ' A' ' 63' ' ' VAL . 11.0 t -58.16 -43.96 87.67 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 -179.7 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' HIS . . . . . 0.411 ' O ' HG23 ' A' ' 69' ' ' VAL . 86.4 t60 -64.61 -51.05 64.72 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.845 179.66 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -61.72 -39.84 92.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.6 179.771 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.3 tp -60.91 -43.56 98.38 Favored 'General case' 0 C--O 1.218 -0.596 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.038 -179.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 72.3 ttt180 -60.73 -42.23 96.89 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-O 120.829 0.347 . . . . 0.0 110.316 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.411 HG23 ' O ' ' A' ' 65' ' ' HIS . 85.7 t -59.97 -54.75 30.42 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 C-N-CA 120.446 -0.502 . . . . 0.0 110.132 -179.201 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.453 ' N ' HD22 ' A' ' 70' ' ' LEU . 4.3 mm? -64.12 -37.83 88.86 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.584 179.079 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 60.1 ttt85 -52.25 -41.7 63.04 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.121 -179.477 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 -56.86 -45.75 82.27 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 120.587 -0.445 . . . . 0.0 110.293 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.0 mt -67.83 -39.06 83.93 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 110.021 -0.363 . . . . 0.0 110.021 179.61 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 96.74 46.47 2.48 Favored Glycine 0 CA--C 1.52 0.364 0 N-CA-C 110.989 -0.845 . . . . 0.0 110.989 -179.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 5.0 tp -105.78 -9.21 17.36 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.91 0.386 . . . . 0.0 110.763 -179.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.9 m -135.65 160.22 39.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.508 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -153.59 174.63 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.91 -179.703 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -143.85 156.48 26.68 Favored Glycine 0 C--N 1.332 0.34 0 N-CA-C 110.825 -0.91 . . . . 0.0 110.825 179.169 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 . . . . . 0 N--CA 1.466 0.349 0 CA-C-O 120.768 0.318 . . . . 0.0 110.4 -179.885 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 3.3 m . . . . . 0 N--CA 1.467 0.422 0 CA-C-O 120.622 0.249 . . . . 0.0 110.767 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.416 ' O ' HD22 ' A' ' 42' ' ' LEU . 71.7 m-85 -89.96 119.07 30.01 Favored 'General case' 0 C--O 1.22 -0.495 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.054 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 66.6 m -133.04 152.59 51.95 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-O 120.966 0.412 . . . . 0.0 110.385 -179.321 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 1.024 HD22 ' H ' ' A' ' 89' ' ' LEU . 0.5 OUTLIER -73.03 137.6 45.45 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.526 179.927 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 66.3 t80 -61.71 -50.31 72.94 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.736 -179.644 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 39.6 t0 -89.75 130.49 36.01 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.793 -179.717 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 11.8 m -93.45 -28.98 15.8 Favored 'General case' 0 C--O 1.244 0.777 0 CA-C-O 121.309 0.576 . . . . 0.0 110.389 179.345 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . 0.579 ' CG ' ' CD2' ' B' ' 223' ' ' HIS . 75.9 m80 -55.21 -46.06 75.9 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.122 179.817 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.554 HG13 ' N ' ' A' ' 95' ' ' ALA . 13.1 p -53.05 -44.21 50.27 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.203 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.554 ' N ' HG13 ' A' ' 94' ' ' VAL . . . -57.08 -37.2 71.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.065 179.124 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -64.06 -38.93 92.87 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-O 121.23 0.538 . . . . 0.0 110.175 179.304 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 50.2 mt -61.21 -44.55 97.1 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.248 179.791 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.43 HD22 ' N ' ' A' ' 98' ' ' LEU . 4.2 mm? -66.94 -37.06 83.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.832 178.52 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -57.51 -47.26 82.43 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.189 -179.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.457 ' OE2' ' OE2' ' B' ' 219' ' ' GLU . 97.7 mt-10 -69.87 -52.31 25.84 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.548 179.238 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . 0.465 ' HB2' HD13 ' B' ' 216' ' ' LEU . . . -53.3 -46.82 69.53 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.519 -179.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 4.8 mm -62.52 -44.53 99.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.352 -179.377 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' TYR . . . . . 0.633 ' CE1' ' NE2' ' A' ' 107' ' ' HIS . 85.1 t80 -60.84 -46.89 88.78 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.989 0.423 . . . . 0.0 110.421 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' HIS . . . . . 0.55 ' CD2' ' CG ' ' B' ' 212' ' ' HIS . 18.3 t-80 -57.0 -39.73 75.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.614 -179.82 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 36.1 t -76.28 -40.35 51.96 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.161 179.647 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -56.78 -33.96 67.15 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.408 -179.213 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . 0.633 ' NE2' ' CE1' ' A' ' 103' ' ' TYR . 9.2 m-70 . . . . . 0 C--N 1.326 -0.437 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.513 179.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 135' ' ' ASP . . . . . 0.424 ' O ' ' HB3' ' B' ' 138' ' ' ALA . 18.3 m-20 . . . . . 0 C--O 1.247 0.927 0 CA-C-O 121.196 0.522 . . . . 0.0 110.725 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 10.0 t -54.07 -57.18 12.05 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.379 -178.64 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 14.0 mp0 -46.01 -47.27 16.82 Favored 'General case' 0 C--O 1.209 -1.038 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 179.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 138' ' ' ALA . . . . . 0.424 ' HB3' ' O ' ' B' ' 135' ' ' ASP . . . -50.04 -56.25 11.55 Favored 'General case' 0 C--O 1.242 0.706 0 C-N-CA 120.423 -0.511 . . . . 0.0 109.998 -178.348 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -64.5 -53.15 52.65 Favored 'General case' 0 N--CA 1.457 -0.108 0 C-N-CA 120.381 -0.528 . . . . 0.0 110.784 179.387 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -51.44 -46.13 62.9 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.875 -179.266 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 68.9 tp60 -55.75 -52.86 62.49 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 120.862 0.363 . . . . 0.0 110.171 -179.291 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 142' ' ' VAL . . . . . . . . . . . . . 90.4 t -63.51 -46.84 94.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.451 179.651 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -57.55 -45.75 84.74 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.394 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 11.3 t -56.07 -41.72 75.55 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 19.3 m -60.64 -49.05 79.06 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.358 179.647 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 146' ' ' LEU . . . . . 0.467 ' N ' ' CD1' ' B' ' 146' ' ' LEU . 7.3 mp -69.44 -22.33 63.67 Favored 'General case' 0 CA--C 1.522 -0.122 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.572 179.172 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 147' ' ' GLN . . . . . 0.525 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 54.4 tt0 -71.58 -66.04 0.68 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.195 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -59.17 -53.64 56.06 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.833 0.349 . . . . 0.0 110.321 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.52 ' O ' ' O ' ' B' ' 150' ' ' ALA . 39.0 tp -45.8 -29.45 1.34 Allowed 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.548 -179.703 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 150' ' ' ALA . . . . . 0.525 ' HB3' ' O ' ' B' ' 147' ' ' GLN . . . -55.46 -125.54 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.36 179.535 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 151' ' ' THR . . . . . 0.463 ' O ' ' O ' ' B' ' 150' ' ' ALA . 90.9 m 56.25 112.73 0.02 OUTLIER Pre-proline 0 N--CA 1.446 -0.633 0 CA-C-N 116.508 -0.314 . . . . 0.0 110.326 179.332 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -48.56 -49.14 15.32 Favored 'Trans proline' 0 C--N 1.305 -1.731 0 C-N-CA 122.47 2.113 . . . . 0.0 112.811 -179.284 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 46.0 m -61.49 -46.64 89.15 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.043 -178.748 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 54.0 ttm-85 -61.33 -44.88 96.45 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.669 -178.541 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 155' ' ' LEU . . . . . 0.581 HD23 ' O ' ' B' ' 155' ' ' LEU . 1.8 tt -60.47 -52.63 64.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.342 -178.594 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 11.3 tpt -51.17 -47.56 62.12 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 120.607 -0.437 . . . . 0.0 109.981 -179.59 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 35.5 mm -63.52 -42.67 96.98 Favored 'Isoleucine or valine' 0 C--O 1.247 0.967 0 CA-C-O 121.123 0.487 . . . . 0.0 110.636 179.216 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 158' ' ' LEU . . . . . 0.555 HD13 ' O ' ' B' ' 158' ' ' LEU . 0.2 OUTLIER -62.57 -42.84 99.8 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.796 -179.447 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 9.2 m -59.15 -41.92 89.5 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.786 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 60.2 tp60 -56.56 -45.77 81.1 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 121.002 0.429 . . . . 0.0 110.298 179.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 161' ' ' LEU . . . . . 0.438 HD22 ' O ' ' B' ' 206' ' ' TYR . 12.7 mt -65.7 -38.3 88.87 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.195 178.316 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 162' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -55.29 -44.27 75.57 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.581 -178.59 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -63.69 -39.24 93.83 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.233 179.214 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 164' ' ' GLY . . . . . 0.428 ' O ' HD12 ' B' ' 166' ' ' LEU . . . -172.66 155.53 23.3 Favored Glycine 0 CA--C 1.528 0.884 0 N-CA-C 111.111 -0.796 . . . . 0.0 111.111 179.547 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 165' ' ' PRO . . . . . 0.43 ' O ' ' O ' ' B' ' 166' ' ' LEU . 49.4 Cg_endo -70.74 -75.56 0.01 OUTLIER 'Trans proline' 0 C--N 1.31 -1.453 0 C-N-CA 122.761 2.307 . . . . 0.0 112.583 179.736 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 166' ' ' LEU . . . . . 0.43 ' O ' ' O ' ' B' ' 165' ' ' PRO . 0.4 OUTLIER 60.08 144.07 0.05 OUTLIER Pre-proline 0 C--N 1.32 -0.675 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.028 178.319 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -66.6 167.14 19.81 Favored 'Trans proline' 0 C--N 1.305 -1.757 0 C-N-CA 122.58 2.186 . . . . 0.0 112.127 179.504 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 168' ' ' VAL . . . . . 0.805 HG12 ' OE1' ' B' ' 179' ' ' GLN . 55.0 t -58.24 -41.93 82.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.897 -179.923 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 169' ' ' THR . . . . . 0.438 ' H ' HG22 ' B' ' 169' ' ' THR . 0.0 OUTLIER -60.2 -41.74 93.63 Favored 'General case' 0 C--O 1.247 0.931 0 CA-C-O 121.501 0.667 . . . . 0.0 110.701 179.69 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -64.5 -38.45 91.06 Favored 'General case' 0 C--O 1.239 0.527 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.127 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 18.9 mt -62.14 -36.1 80.78 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.356 179.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 172' ' ' ALA . . . . . 0.474 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -60.66 -46.27 90.98 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.922 178.936 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -57.76 -48.13 80.54 Favored 'General case' 0 C--O 1.236 0.342 0 C-N-CA 120.553 -0.459 . . . . 0.0 110.285 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -65.03 -45.57 84.88 Favored 'General case' 0 C--O 1.232 0.163 0 C-N-CA 120.696 -0.402 . . . . 0.0 110.633 179.712 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 97.0 mt -96.8 -79.08 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.604 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 176' ' ' GLY . . . . . 0.474 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 156.86 103.3 0.2 Allowed Glycine 0 CA--C 1.525 0.666 0 N-CA-C 110.74 -0.944 . . . . 0.0 110.74 -179.683 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 177' ' ' MET . . . . . 0.538 ' O ' ' NE2' ' B' ' 179' ' ' GLN . 74.7 mtp 41.35 -113.16 0.18 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.181 0.515 . . . . 0.0 110.578 179.823 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 50.09 11.9 0.07 Allowed 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.305 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 179' ' ' GLN . . . . . 0.805 ' OE1' HG12 ' B' ' 168' ' ' VAL . 2.7 mm-40 -48.74 -29.33 4.37 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.752 179.778 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 38.9 m -73.04 -33.93 65.99 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.307 179.704 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -70.02 -38.87 76.02 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.119 -178.734 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 182' ' ' VAL . . . . . 0.446 HG23 ' N ' ' B' ' 183' ' ' SER . 11.0 m -71.42 -47.19 60.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.483 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 183' ' ' SER . . . . . 0.446 ' N ' HG23 ' B' ' 182' ' ' VAL . 10.5 t -57.73 -44.1 85.77 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 184' ' ' HIS . . . . . 0.409 ' O ' HG23 ' B' ' 188' ' ' VAL . 86.1 t60 -65.58 -51.71 57.68 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.809 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -60.99 -41.54 96.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.534 179.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 7.5 tp -59.53 -44.21 93.26 Favored 'General case' 0 C--O 1.216 -0.665 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.201 -179.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 72.9 ttt180 -60.09 -42.64 95.07 Favored 'General case' 0 C--O 1.242 0.671 0 CA-C-O 120.991 0.424 . . . . 0.0 110.414 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 188' ' ' VAL . . . . . 0.409 HG23 ' O ' ' B' ' 184' ' ' HIS . 88.7 t -59.46 -54.46 34.08 Favored 'Isoleucine or valine' 0 C--O 1.232 0.135 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.012 -179.211 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 189' ' ' LEU . . . . . 0.456 ' N ' ' CD2' ' B' ' 189' ' ' LEU . 4.1 mm? -64.42 -38.08 89.78 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.572 178.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 61.2 ttt85 -51.23 -39.72 57.25 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.321 -179.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -60.36 -40.1 89.56 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.809 0.337 . . . . 0.0 110.237 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 192' ' ' LEU . . . . . 0.431 HD23 ' N ' ' B' ' 192' ' ' LEU . 7.4 mt -71.59 -37.72 70.96 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.489 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 95.19 42.5 3.73 Favored Glycine 0 CA--C 1.522 0.502 0 N-CA-C 110.766 -0.934 . . . . 0.0 110.766 -179.282 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 5.1 tp -103.99 -9.55 18.77 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.794 0.33 . . . . 0.0 110.921 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 195' ' ' VAL . . . . . 0.413 ' O ' HG13 ' B' ' 196' ' ' VAL . 3.4 m -135.71 159.78 39.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.659 -179.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 196' ' ' VAL . . . . . 0.413 HG13 ' O ' ' B' ' 195' ' ' VAL . 0.2 OUTLIER -155.2 176.39 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.823 -179.83 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 197' ' ' GLY . . . . . . . . . . . . . . . -145.47 158.3 27.61 Favored Glycine 0 CA--C 1.52 0.397 0 N-CA-C 110.723 -0.951 . . . . 0.0 110.723 179.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 . . . . . 0 N--CA 1.466 0.375 0 CA-C-O 120.673 0.273 . . . . 0.0 110.368 -179.881 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 3.0 m . . . . . 0 N--CA 1.466 0.345 0 CA-C-O 120.568 0.223 . . . . 0.0 110.719 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 206' ' ' TYR . . . . . 0.438 ' O ' HD22 ' B' ' 161' ' ' LEU . 71.9 m-85 -90.37 118.33 29.78 Favored 'General case' 0 C--O 1.219 -0.533 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.005 -179.776 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 63.7 m -133.46 152.68 51.94 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.013 0.435 . . . . 0.0 110.327 -179.309 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 208' ' ' LEU . . . . . 1.031 HD22 ' H ' ' B' ' 208' ' ' LEU . 0.5 OUTLIER -73.37 136.52 44.39 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.652 179.845 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 209' ' ' TYR . . . . . 0.407 ' H ' ' HA ' ' B' ' 195' ' ' VAL . 63.4 t80 -61.68 -47.65 84.36 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.554 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -90.29 129.36 36.53 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.695 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 23.6 m -94.02 -31.06 14.39 Favored 'General case' 0 C--O 1.244 0.808 0 CA-C-O 121.334 0.587 . . . . 0.0 110.304 179.43 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 212' ' ' HIS . . . . . 0.55 ' CG ' ' CD2' ' A' ' 104' ' ' HIS . 75.3 m80 -54.44 -45.09 73.0 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 115.89 -0.595 . . . . 0.0 109.995 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 213' ' ' VAL . . . . . 0.569 HG13 ' N ' ' B' ' 214' ' ' ALA . 13.1 p -52.82 -43.67 46.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.054 0.454 . . . . 0.0 110.124 179.836 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 214' ' ' ALA . . . . . 0.569 ' N ' HG13 ' B' ' 213' ' ' VAL . . . -57.69 -38.12 74.64 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.014 179.053 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 57.2 tt0 -62.72 -39.5 94.26 Favored 'General case' 0 C--O 1.238 0.459 0 CA-C-O 121.258 0.551 . . . . 0.0 110.119 179.318 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 216' ' ' LEU . . . . . 0.465 HD13 ' HB2' ' A' ' 101' ' ' ALA . 48.9 mt -61.38 -44.87 96.41 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.298 179.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 217' ' ' LEU . . . . . 0.401 ' N ' ' CD2' ' B' ' 217' ' ' LEU . 4.1 mm? -66.45 -37.3 84.84 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.886 178.383 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -57.59 -47.36 82.32 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.14 -179.042 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 219' ' ' GLU . . . . . 0.457 ' OE2' ' OE2' ' A' ' 100' ' ' GLU . 94.6 mt-10 -69.91 -51.5 32.49 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.607 179.185 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -53.64 -47.68 70.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.459 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 4.4 mm -62.07 -44.76 99.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.432 -179.251 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 222' ' ' TYR . . . . . 0.593 ' CE1' ' NE2' ' B' ' 226' ' ' HIS . 74.5 t80 -60.09 -47.37 86.16 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.943 0.402 . . . . 0.0 110.427 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 223' ' ' HIS . . . . . 0.579 ' CD2' ' CG ' ' A' ' 93' ' ' HIS . 17.7 t-80 -56.75 -39.24 73.64 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.586 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 32.9 t -76.74 -40.53 48.19 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.066 179.778 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 82.9 tt0 -56.78 -34.85 68.03 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.355 -179.254 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 226' ' ' HIS . . . . . 0.593 ' NE2' ' CE1' ' B' ' 222' ' ' TYR . 8.0 m-70 . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.483 179.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . 0.523 ' O ' ' N ' ' A' ' 19' ' ' ALA . 98.9 m-20 . . . . . 0 C--O 1.232 0.161 0 CA-C-O 120.6 0.238 . . . . 0.0 110.722 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.405 ' C ' ' O ' ' A' ' 16' ' ' ASP . 91.3 p -38.31 -38.5 0.36 Allowed 'General case' 0 C--O 1.24 0.583 0 CA-C-O 121.231 0.539 . . . . 0.0 110.6 -179.509 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 25.1 pt20 -65.33 -44.02 89.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.328 179.144 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.544 ' O ' HG23 ' A' ' 23' ' ' VAL . . . -63.67 -28.6 70.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.202 179.456 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.36 -51.73 48.64 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.239 179.68 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.06 -46.5 89.36 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.71 179.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -54.48 -50.58 67.42 Favored 'General case' 0 C--O 1.241 0.648 0 CA-C-O 121.177 0.513 . . . . 0.0 110.471 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.544 HG23 ' O ' ' A' ' 19' ' ' ALA . 92.2 t -62.76 -44.73 99.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.42 179.573 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.554 ' HB1' ' N ' ' B' ' 151' ' ' THR . . . -53.6 -44.05 69.11 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 10.9 t -59.91 -43.88 94.6 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 11.1 m -63.73 -46.95 83.06 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.025 0.441 . . . . 0.0 110.39 179.289 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 95.4 mt -67.26 -21.12 65.73 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.643 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 58.2 tt0 -75.81 -56.36 4.75 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.637 179.329 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.12 -54.61 45.02 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.448 -179.466 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.486 ' O ' ' O ' ' A' ' 31' ' ' ALA . 93.3 mt -47.56 -41.96 22.56 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.557 -179.205 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.517 ' O ' ' CB ' ' A' ' 32' ' ' THR . . . -50.04 -174.97 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.017 179.752 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.544 ' N ' ' HB1' ' B' ' 143' ' ' ALA . 1.0 OUTLIER 88.37 118.3 0.03 OUTLIER Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.031 179.961 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -46.7 -46.58 17.69 Favored 'Trans proline' 0 N--CA 1.496 1.659 0 C-N-CA 122.368 2.045 . . . . 0.0 113.113 -178.662 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 11.6 t -58.97 -44.5 91.55 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.813 -179.118 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 22.5 mmt85 -62.0 -46.15 90.46 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 120.675 -0.41 . . . . 0.0 110.984 -179.315 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.467 ' CD2' ' O ' ' A' ' 30' ' ' LEU . 4.2 mm? -62.87 -47.31 83.88 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.974 -179.567 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.5 ' SD ' HD11 ' A' ' 56' ' ' ILE . 14.3 tmm? -58.32 -49.22 77.97 Favored 'General case' 0 C--N 1.32 -0.677 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.545 -179.673 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 32.9 mm -63.96 -44.62 97.96 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.789 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 49.3 mt -62.12 -42.35 99.14 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.754 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 19.5 m -60.16 -41.32 92.56 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.2 -0.455 . . . . 0.0 109.896 179.554 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.539 ' N ' ' OE1' ' A' ' 41' ' ' GLN . 0.1 OUTLIER -57.85 -49.68 75.86 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.262 -0.426 . . . . 0.0 109.928 179.992 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 98.3 mt -63.77 -42.55 97.76 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.455 -0.498 . . . . 0.0 110.685 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 72.7 ttp85 -71.53 -21.12 61.95 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.646 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 62.0 t-20 -62.46 -41.22 98.61 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.934 0.397 . . . . 0.0 110.48 -179.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 159.34 -166.59 34.78 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 111.088 -0.805 . . . . 0.0 111.088 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_exo -73.51 115.51 4.36 Favored 'Trans proline' 0 N--CA 1.492 1.415 0 C-N-CA 122.888 2.392 . . . . 0.0 112.151 179.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.449 ' O ' ' O ' ' A' ' 48' ' ' PRO . 0.3 OUTLIER -158.34 84.61 2.58 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.106 179.911 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . 0.449 ' O ' ' O ' ' A' ' 47' ' ' LEU . 51.2 Cg_exo -51.14 -166.57 0.0 OUTLIER 'Trans proline' 0 C--N 1.303 -1.855 0 C-N-CA 122.471 2.114 . . . . 0.0 112.385 179.699 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 55.0 t -59.69 -51.06 77.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 121.072 0.463 . . . . 0.0 111.291 -179.265 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.423 HG22 ' H ' ' A' ' 50' ' ' THR . 0.1 OUTLIER -57.33 -44.84 84.57 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.257 0.551 . . . . 0.0 109.921 179.957 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 -65.09 -33.99 77.34 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.592 -0.522 . . . . 0.0 109.592 179.429 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.591 ' O ' HD13 ' A' ' 52' ' ' LEU . 0.2 OUTLIER -62.05 -43.26 99.21 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 120.541 -0.463 . . . . 0.0 110.09 -179.777 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.81 -45.04 96.01 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.587 179.407 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 41.1 tp10 -65.03 -30.42 71.4 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.369 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -70.28 -53.98 14.56 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.853 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.5 HD11 ' SD ' ' A' ' 37' ' ' MET . 90.2 mt -94.26 -68.67 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.247 179.858 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 134.2 97.72 0.6 Allowed Glycine 0 C--N 1.332 0.322 0 N-CA-C 111.348 -0.701 . . . . 0.0 111.348 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 65.6 mtt 60.02 97.38 0.03 OUTLIER 'General case' 0 CA--C 1.519 -0.212 0 C-N-CA 120.819 -0.352 . . . . 0.0 110.928 178.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -179.6 19.15 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.488 179.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 56.0 mt-30 -54.4 -26.72 32.16 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.365 0.602 . . . . 0.0 110.797 -179.047 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 78.1 p -74.39 -31.48 62.36 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.237 179.353 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -74.6 -38.98 62.46 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.446 -178.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.599 HG13 ' N ' ' A' ' 64' ' ' SER . 7.6 p -73.81 -50.63 28.21 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 CA-C-N 116.515 -0.312 . . . . 0.0 110.381 179.898 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.599 ' N ' HG13 ' A' ' 63' ' ' VAL . 45.4 t -58.37 -43.76 88.58 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 120.509 -0.477 . . . . 0.0 110.362 -179.787 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' HIS . . . . . 0.472 ' O ' HG23 ' A' ' 69' ' ' VAL . 55.6 t-80 -67.0 -45.55 77.24 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.859 179.686 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -63.86 -48.49 76.51 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.974 -179.192 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -61.84 -44.55 96.62 Favored 'General case' 0 CA--C 1.503 -0.829 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.877 -179.343 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 60.8 ttp180 -59.55 -44.35 93.27 Favored 'General case' 0 C--N 1.315 -0.891 0 CA-C-O 121.059 0.457 . . . . 0.0 110.377 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.472 HG23 ' O ' ' A' ' 65' ' ' HIS . 47.9 t -59.24 -51.83 67.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 C-N-CA 120.344 -0.542 . . . . 0.0 110.055 -179.85 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 95.6 mt -67.9 -27.68 66.85 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.976 0.417 . . . . 0.0 110.467 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 74.2 ttt180 -62.31 -42.43 99.36 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.408 -179.695 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 -60.56 -44.52 96.08 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 120.599 -0.441 . . . . 0.0 110.357 -179.672 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 10.2 mt -65.3 -39.01 91.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.318 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 99.4 60.05 0.87 Allowed Glycine 0 N--CA 1.462 0.403 0 N-CA-C 110.717 -0.953 . . . . 0.0 110.717 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 27.9 tp -118.53 -15.91 9.55 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 121.006 0.431 . . . . 0.0 110.352 -179.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 21.2 m -131.37 163.64 36.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.087 0.47 . . . . 0.0 110.281 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.582 HG12 ' N ' ' A' ' 78' ' ' GLY . 91.9 t -143.62 163.22 15.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.803 -179.481 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . 0.582 ' N ' HG12 ' A' ' 77' ' ' VAL . . . -108.56 161.24 13.35 Favored Glycine 0 CA--C 1.524 0.597 0 N-CA-C 110.584 -1.006 . . . . 0.0 110.584 179.606 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 . . . . . 0 C--N 1.328 -0.368 0 CA-C-O 120.761 0.315 . . . . 0.0 110.568 179.798 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 70.2 t . . . . . 0 N--CA 1.464 0.26 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 64.4 m-85 -90.93 124.6 35.33 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.387 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 65.5 m -138.67 158.79 43.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.516 -179.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 18.2 mt -66.88 140.47 57.79 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.315 -179.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.405 ' CD1' ' C ' ' A' ' 90' ' ' TYR . 14.5 t80 -57.12 -50.7 71.98 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.642 -179.76 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -100.98 134.27 44.22 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.879 0.371 . . . . 0.0 110.608 -179.486 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 70.8 p -74.26 -26.66 60.34 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.363 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 74.0 m80 -56.36 -43.69 79.38 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.338 -179.772 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 75.0 t -56.94 -43.06 79.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -179.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.37 -43.03 99.57 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.252 179.497 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 68.1 tp60 -64.34 -42.59 96.18 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.177 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 12.6 tp -59.02 -43.66 91.61 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.964 -179.373 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 90.4 mt -64.34 -39.71 94.44 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.191 179.444 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -58.92 -42.39 89.56 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.437 -179.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -66.16 -53.71 34.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.514 179.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.95 -41.06 86.54 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.021 0.438 . . . . 0.0 110.49 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 4.0 mm -61.63 -44.58 98.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.519 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' TYR . . . . . 0.508 ' O ' ' ND1' ' A' ' 107' ' ' HIS . 4.0 m-85 -66.21 -38.29 87.61 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.139 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 3.8 t60 -58.64 -42.81 89.19 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.589 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 29.8 t -79.45 -36.61 38.58 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.036 0.446 . . . . 0.0 111.22 179.386 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 48.1 tp10 -55.68 -40.77 72.76 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.433 -178.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . 0.508 ' ND1' ' O ' ' A' ' 103' ' ' TYR . 36.0 m80 . . . . . 0 N--CA 1.453 -0.292 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 -179.196 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 135' ' ' ASP . . . . . 0.503 ' O ' ' N ' ' B' ' 138' ' ' ALA . 94.4 m-20 . . . . . 0 C--O 1.232 0.161 0 CA-C-O 120.555 0.217 . . . . 0.0 110.624 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 69.3 p -38.35 -38.65 0.38 Allowed 'General case' 0 C--O 1.239 0.512 0 CA-C-O 121.285 0.564 . . . . 0.0 110.423 -179.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 137' ' ' GLN . . . . . 0.419 ' CG ' ' N ' ' B' ' 138' ' ' ALA . 23.5 pt20 -65.9 -45.18 82.93 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.398 179.174 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 138' ' ' ALA . . . . . 0.516 ' O ' HG23 ' B' ' 142' ' ' VAL . . . -63.18 -28.16 69.86 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.163 179.708 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.28 -50.82 51.13 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.28 179.703 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -60.33 -46.32 90.3 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.534 179.724 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -54.39 -51.32 65.21 Favored 'General case' 0 C--O 1.241 0.646 0 CA-C-O 121.27 0.557 . . . . 0.0 110.544 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 142' ' ' VAL . . . . . 0.516 HG23 ' O ' ' B' ' 138' ' ' ALA . 90.5 t -62.7 -45.88 97.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.451 179.686 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 143' ' ' ALA . . . . . 0.544 ' HB1' ' N ' ' A' ' 32' ' ' THR . . . -52.05 -44.58 64.32 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 36.7 t -59.43 -44.44 92.9 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.039 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 8.1 m -63.68 -47.06 82.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.485 179.511 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 93.6 mt -66.53 -20.69 66.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.621 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 147' ' ' GLN . . . . . 0.416 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 58.8 tt0 -75.78 -56.85 4.29 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.585 179.287 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -57.93 -54.71 43.83 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.362 -179.424 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.483 ' O ' ' O ' ' B' ' 150' ' ' ALA . 94.2 mt -46.93 -41.7 16.49 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.359 -179.245 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 150' ' ' ALA . . . . . 0.519 ' O ' ' CB ' ' B' ' 151' ' ' THR . . . -50.6 -174.33 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.147 -0.479 . . . . 0.0 109.978 179.651 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 151' ' ' THR . . . . . 0.554 ' N ' ' HB1' ' A' ' 24' ' ' ALA . 1.0 OUTLIER 88.14 117.84 0.03 OUTLIER Pre-proline 0 CA--C 1.538 0.518 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 179.833 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -46.74 -46.47 18.03 Favored 'Trans proline' 0 N--CA 1.495 1.586 0 C-N-CA 122.322 2.015 . . . . 0.0 113.063 -178.518 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 48.1 t -58.97 -44.42 91.53 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.969 -179.253 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 20.7 mmt85 -61.78 -45.91 91.84 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.739 -0.385 . . . . 0.0 111.042 -179.463 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 155' ' ' LEU . . . . . 0.461 ' CD2' ' O ' ' B' ' 149' ' ' LEU . 4.2 mm? -62.76 -47.71 82.35 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 120.598 -0.441 . . . . 0.0 111.073 -179.853 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 156' ' ' MET . . . . . 0.527 ' SD ' HD11 ' B' ' 175' ' ' ILE . 14.4 tmm? -58.29 -49.24 77.84 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 120.337 -0.545 . . . . 0.0 110.612 -179.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 5.9 mm -64.4 -44.91 97.16 Favored 'Isoleucine or valine' 0 C--O 1.239 0.507 0 CA-C-O 121.098 0.475 . . . . 0.0 110.823 -179.504 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 57.7 mt -62.09 -41.77 98.53 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.599 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 28.0 m -59.75 -41.9 92.02 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.179 -0.464 . . . . 0.0 109.815 179.292 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 160' ' ' GLN . . . . . 0.55 ' OE1' ' N ' ' B' ' 160' ' ' GLN . 0.0 OUTLIER -58.02 -49.24 77.55 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.854 -0.425 . . . . 0.0 109.854 179.958 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 161' ' ' LEU . . . . . . . . . . . . . 97.5 mt -63.95 -42.75 97.21 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 120.373 -0.531 . . . . 0.0 110.573 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 162' ' ' ARG . . . . . . . . . . . . . 72.5 ttp85 -71.3 -21.0 62.13 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.51 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 59.4 t-20 -63.18 -41.87 99.27 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.579 -179.53 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . 162.26 -165.44 36.01 Favored Glycine 0 CA--C 1.528 0.853 0 N-CA-C 111.017 -0.833 . . . . 0.0 111.017 -179.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -79.06 112.98 3.15 Favored 'Trans proline' 0 C--N 1.31 -1.486 0 C-N-CA 122.958 2.439 . . . . 0.0 111.769 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 166' ' ' LEU . . . . . 0.436 ' O ' ' O ' ' B' ' 167' ' ' PRO . 0.3 OUTLIER -153.35 85.86 4.11 Favored Pre-proline 0 C--N 1.325 -0.486 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.264 -178.935 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 167' ' ' PRO . . . . . 0.436 ' O ' ' O ' ' B' ' 166' ' ' LEU . 51.4 Cg_exo -50.69 -167.94 0.0 OUTLIER 'Trans proline' 0 C--N 1.306 -1.692 0 C-N-CA 122.607 2.205 . . . . 0.0 112.243 179.76 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . 80.0 t -59.59 -50.41 80.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.973 -179.209 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 169' ' ' THR . . . . . 0.43 ' H ' HG22 ' B' ' 169' ' ' THR . 0.0 OUTLIER -57.54 -44.77 85.44 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.281 0.562 . . . . 0.0 109.976 -179.835 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 -65.51 -34.69 78.85 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.632 179.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 171' ' ' LEU . . . . . 0.603 ' O ' HD13 ' B' ' 171' ' ' LEU . 0.2 OUTLIER -61.62 -44.47 96.92 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 120.466 -0.493 . . . . 0.0 110.02 -179.614 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 172' ' ' ALA . . . . . . . . . . . . . . . -60.39 -44.33 95.78 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 179.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 45.3 tp10 -64.89 -30.65 71.66 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.388 179.736 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -69.92 -54.46 13.3 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.846 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 175' ' ' ILE . . . . . 0.527 HD11 ' SD ' ' B' ' 156' ' ' MET . 93.1 mt -93.56 -68.18 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.293 179.848 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . 133.46 96.75 0.6 Allowed Glycine 0 C--N 1.332 0.333 0 N-CA-C 111.317 -0.713 . . . . 0.0 111.317 -179.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 61.6 mtt 61.91 96.68 0.03 OUTLIER 'General case' 0 CA--C 1.52 -0.19 0 CA-C-O 120.713 0.292 . . . . 0.0 110.765 178.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -178.93 19.02 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.58 179.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 56.0 mt-30 -54.23 -27.24 33.36 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.36 0.6 . . . . 0.0 110.848 -179.059 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 78.5 p -74.41 -32.71 62.77 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.394 179.546 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -73.29 -38.75 65.77 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.584 -178.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 182' ' ' VAL . . . . . 0.583 HG13 ' N ' ' B' ' 183' ' ' SER . 7.3 p -73.42 -49.73 35.04 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.509 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.436 179.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 183' ' ' SER . . . . . 0.583 ' N ' HG13 ' B' ' 182' ' ' VAL . 43.0 t -58.09 -43.77 87.26 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 120.706 -0.397 . . . . 0.0 110.129 -179.533 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 184' ' ' HIS . . . . . 0.495 ' O ' HG23 ' B' ' 188' ' ' VAL . 54.7 t-80 -67.16 -45.01 78.29 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.618 179.687 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -63.65 -49.76 71.97 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.708 -179.411 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -61.31 -44.27 97.48 Favored 'General case' 0 CA--C 1.502 -0.888 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.789 -179.532 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 60.5 ttp180 -59.62 -44.9 93.28 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.143 0.497 . . . . 0.0 110.469 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 188' ' ' VAL . . . . . 0.495 HG23 ' O ' ' B' ' 184' ' ' HIS . 44.2 t -58.93 -52.17 63.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.196 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 86.1 mt -67.82 -28.38 67.52 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.938 0.399 . . . . 0.0 110.361 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 74.9 ttt180 -61.52 -42.34 98.67 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.412 -179.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -60.49 -45.36 94.04 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.71 -0.396 . . . . 0.0 110.437 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 192' ' ' LEU . . . . . . . . . . . . . 10.0 mt -65.03 -40.13 94.38 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.315 179.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 101.0 53.85 1.0 Allowed Glycine 0 N--CA 1.462 0.412 0 N-CA-C 111.005 -0.838 . . . . 0.0 111.005 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 14.9 tp -111.94 -15.06 13.4 Favored 'General case' 0 N--CA 1.462 0.125 0 CA-C-O 120.885 0.374 . . . . 0.0 110.618 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 23.9 m -132.13 163.76 36.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 121.015 0.436 . . . . 0.0 110.349 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 196' ' ' VAL . . . . . 0.598 HG12 ' N ' ' B' ' 197' ' ' GLY . 96.4 t -144.33 163.42 14.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.686 -179.6 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 197' ' ' GLY . . . . . 0.598 ' N ' HG12 ' B' ' 196' ' ' VAL . . . -109.21 160.04 13.74 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.534 -1.026 . . . . 0.0 110.534 179.598 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 . . . . . 0 C--N 1.327 -0.388 0 CA-C-O 120.738 0.304 . . . . 0.0 110.734 179.971 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 69.8 t . . . . . 0 N--CA 1.464 0.242 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 59.0 m-85 -91.8 125.12 36.39 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.512 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 67.8 m -139.26 158.53 43.99 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.502 -179.549 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . 15.9 mt -66.91 138.91 57.64 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.457 -179.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 15.2 t80 -54.77 -51.99 64.0 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.674 -179.772 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 63.8 m-20 -99.85 135.36 41.39 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.827 0.346 . . . . 0.0 110.673 -179.396 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 76.2 p -75.74 -24.26 56.09 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.374 179.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 212' ' ' HIS . . . . . . . . . . . . . 74.3 m80 -57.32 -43.48 83.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.289 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 74.5 t -57.67 -43.58 83.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 214' ' ' ALA . . . . . . . . . . . . . . . -59.7 -45.61 91.59 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.366 179.478 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 69.5 tp60 -63.63 -41.94 98.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.265 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 216' ' ' LEU . . . . . . . . . . . . . 14.6 tp -59.05 -43.93 91.73 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.025 -179.283 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 82.1 mt -64.51 -39.41 93.73 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.099 179.526 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -58.82 -42.3 88.89 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.514 -179.778 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 219' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -67.14 -51.43 54.04 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.534 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -59.77 -41.48 91.18 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.062 0.458 . . . . 0.0 110.406 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 4.4 mm -61.78 -44.04 98.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.674 -179.714 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 222' ' ' TYR . . . . . 0.432 ' O ' ' ND1' ' B' ' 226' ' ' HIS . 4.2 m-85 -66.36 -38.53 87.79 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.271 179.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 223' ' ' HIS . . . . . . . . . . . . . 3.3 t60 -58.48 -43.08 88.86 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.526 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 37.5 t -77.89 -36.27 49.81 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.9 179.494 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 37.0 tp10 -59.86 -30.94 69.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.529 -179.276 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 226' ' ' HIS . . . . . 0.432 ' ND1' ' O ' ' B' ' 222' ' ' TYR . 27.3 m80 . . . . . 0 CA--C 1.507 -0.704 0 CA-C-O 118.681 -0.676 . . . . 0.0 111.264 -179.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . 0.525 ' O ' ' N ' ' A' ' 19' ' ' ALA . 99.2 m-20 . . . . . 0 CA--C 1.523 -0.086 0 CA-C-O 120.416 0.15 . . . . 0.0 110.63 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 86.4 p -38.46 -40.16 0.53 Allowed 'General case' 0 C--O 1.236 0.368 0 CA-C-O 121.239 0.542 . . . . 0.0 110.473 -179.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 94.8 mm-40 -65.49 -42.93 91.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.191 179.235 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.525 ' N ' ' O ' ' A' ' 16' ' ' ASP . . . -65.79 -28.77 69.26 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.501 179.407 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.61 -52.84 27.13 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.376 179.718 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.8 -49.58 76.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.914 0.387 . . . . 0.0 111.153 179.563 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 66.5 tp60 -53.62 -50.11 66.39 Favored 'General case' 0 C--O 1.242 0.682 0 CA-C-O 121.722 0.772 . . . . 0.0 109.996 -179.559 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.424 HG23 ' O ' ' A' ' 19' ' ' ALA . 57.7 t -62.59 -41.76 93.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.639 -0.709 . . . . 0.0 109.689 179.517 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.462 ' HB2' HD12 ' B' ' 155' ' ' LEU . . . -50.68 -47.43 58.81 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.176 179.785 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 40.3 t -60.22 -43.84 95.67 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.318 -0.401 . . . . 0.0 109.982 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 24.2 m -63.24 -51.77 64.87 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.253 -0.579 . . . . 0.0 110.934 179.72 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 88.6 mt -67.76 -21.1 65.28 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.761 -179.603 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.428 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 52.7 tt0 -75.05 -60.56 2.24 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.759 179.467 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.494 ' HB1' ' NH1' ' A' ' 35' ' ' ARG . . . -58.33 -53.04 62.74 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.863 -179.063 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.432 ' O ' ' C ' ' A' ' 31' ' ' ALA . 4.0 mm? -51.23 -41.37 60.27 Favored 'General case' 0 CA--C 1.509 -0.634 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 -178.475 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.563 ' O ' ' C ' ' A' ' 32' ' ' THR . . . -39.22 -70.81 0.09 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.431 179.757 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.563 ' C ' ' O ' ' A' ' 31' ' ' ALA . 7.1 p -3.35 107.16 0.03 OUTLIER Pre-proline 0 N--CA 1.48 1.027 0 O-C-N 124.583 1.177 . . . . 0.0 111.018 -179.685 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -47.3 -48.47 15.0 Favored 'Trans proline' 0 C--N 1.307 -1.611 0 C-N-CA 122.073 1.849 . . . . 0.0 113.31 -177.635 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 11.1 t -57.62 -44.14 85.28 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.659 -179.297 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.494 ' NH1' ' HB1' ' A' ' 29' ' ' ALA . 38.5 ttm180 -61.18 -45.24 95.43 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 120.643 -0.423 . . . . 0.0 110.71 -179.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.548 ' O ' HG23 ' A' ' 40' ' ' THR . 80.3 mt -57.69 -52.28 66.09 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.313 -0.555 . . . . 0.0 110.707 -179.761 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.43 ' O ' ' OG1' ' A' ' 40' ' ' THR . 53.9 ttp -53.63 -46.23 70.42 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.221 -0.592 . . . . 0.0 110.583 179.412 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.603 HD12 HE22 ' A' ' 66' ' ' GLN . 97.5 mt -62.36 -48.03 90.26 Favored 'Isoleucine or valine' 0 C--O 1.239 0.529 0 CA-C-O 121.332 0.587 . . . . 0.0 110.798 -179.572 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -61.89 -41.56 98.03 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.575 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.548 HG23 ' O ' ' A' ' 36' ' ' LEU . 37.4 p -61.77 -33.98 75.06 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.988 179.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 60.8 tp60 -64.47 -50.49 67.27 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 120.603 -0.439 . . . . 0.0 109.897 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 16.6 mt -62.86 -30.45 71.52 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.495 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 10.8 ttm180 -42.58 -41.29 2.99 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.586 -179.512 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 95.1 m-20 -62.36 -42.92 99.78 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.981 0.42 . . . . 0.0 110.186 -179.747 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 162.23 178.32 36.01 Favored Glycine 0 CA--C 1.527 0.8 0 C-N-CA 120.559 -0.829 . . . . 0.0 111.361 179.027 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 15.1 Cg_exo -67.33 148.07 79.21 Favored 'Trans proline' 0 N--CA 1.49 1.28 0 C-N-CA 122.85 2.367 . . . . 0.0 111.899 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.569 HD12 ' O ' ' A' ' 47' ' ' LEU . 0.3 OUTLIER -164.43 159.4 15.86 Favored Pre-proline 0 CA--C 1.536 0.414 0 C-N-CA 120.262 -0.575 . . . . 0.0 110.793 178.734 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_exo -66.79 149.33 83.48 Favored 'Trans proline' 0 N--CA 1.496 1.629 0 C-N-CA 122.589 2.193 . . . . 0.0 112.292 178.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.46 HG23 ' N ' ' A' ' 50' ' ' THR . 5.0 m -64.57 -39.73 86.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.815 0.817 . . . . 0.0 110.695 179.193 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.46 ' N ' HG23 ' A' ' 49' ' ' VAL . 8.5 m -56.34 -66.08 0.5 Allowed 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 114.738 -1.119 . . . . 0.0 110.548 179.316 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -50.43 -39.24 46.97 Favored 'General case' 0 C--O 1.24 0.559 0 CA-C-O 121.441 0.639 . . . . 0.0 109.645 -179.204 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.57 HD23 ' O ' ' A' ' 52' ' ' LEU . 1.4 tt -59.55 -42.17 91.77 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.859 -0.61 . . . . 0.0 109.433 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.533 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -65.0 -42.87 94.11 Favored 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 120.863 -0.335 . . . . 0.0 110.135 179.591 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 83.6 tt0 -53.62 -34.23 57.79 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 179.901 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -72.13 -38.87 69.17 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.582 178.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 96.8 mt -88.41 -68.95 0.62 Allowed 'Isoleucine or valine' 0 CA--C 1.521 -0.173 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.244 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . 0.533 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 148.94 71.25 0.01 OUTLIER Glycine 0 CA--C 1.521 0.451 0 N-CA-C 111.682 -0.567 . . . . 0.0 111.682 179.617 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 4.1 mmt 57.83 79.15 0.21 Allowed 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 120.779 0.323 . . . . 0.0 110.641 179.35 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 86.4 mt-10 -150.91 19.93 0.78 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.729 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -61.77 -30.64 70.93 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.411 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 36.0 t -65.26 -42.94 92.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.524 -179.8 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.53 -30.88 71.62 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.082 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 89.8 t -70.49 -49.91 49.39 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.209 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.566 179.436 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 38.8 t -57.06 -42.56 80.79 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 120.892 0.377 . . . . 0.0 110.249 -179.787 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 43.5 t60 -60.91 -50.6 72.76 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-O 121.259 0.552 . . . . 0.0 110.499 179.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . 0.603 HE22 HD12 ' A' ' 38' ' ' ILE . 37.0 mt-30 -62.32 -34.54 76.82 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.069 179.646 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.483 HD21 HH21 ' A' ' 71' ' ' ARG . 2.4 tp -62.91 -43.68 98.14 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.223 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 95.5 mtt-85 -62.57 -41.56 99.0 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 120.849 0.356 . . . . 0.0 110.186 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 86.2 t -63.1 -53.84 41.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.199 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 12.5 mt -61.13 -40.85 95.35 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.027 0.441 . . . . 0.0 110.048 -179.485 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.483 HH21 HD21 ' A' ' 67' ' ' LEU . 62.2 ttm-85 -54.83 -41.01 70.16 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.941 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 -60.14 -48.18 82.81 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 120.396 -0.522 . . . . 0.0 110.495 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.4 mt -66.87 -41.47 87.21 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.936 0.398 . . . . 0.0 110.555 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 100.41 88.99 2.02 Favored Glycine 0 CA--C 1.52 0.389 0 N-CA-C 110.947 -0.861 . . . . 0.0 110.947 -179.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 5.1 tp -152.2 -14.17 0.18 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.749 0.309 . . . . 0.0 110.853 179.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.434 ' HA ' ' H ' ' A' ' 90' ' ' TYR . 28.1 m -134.96 158.64 41.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.066 -179.701 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.681 HG12 ' N ' ' A' ' 78' ' ' GLY . 59.4 t -124.07 170.98 13.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.276 -179.635 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . 0.681 ' N ' HG12 ' A' ' 77' ' ' VAL . . . -158.53 149.13 19.17 Favored Glycine 0 CA--C 1.526 0.733 0 N-CA-C 110.604 -0.998 . . . . 0.0 110.604 179.386 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 62.7 t0 . . . . . 0 N--CA 1.467 0.388 0 CA-C-O 120.905 0.383 . . . . 0.0 110.447 -179.911 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 52.2 t . . . . . 0 N--CA 1.465 0.303 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.583 ' N ' ' CD1' ' A' ' 87' ' ' TYR . 0.2 OUTLIER -112.25 136.06 52.15 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.063 -179.815 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 1.9 m -150.92 171.66 16.9 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.805 -0.442 . . . . 0.0 109.805 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 34.0 mt -84.28 143.31 29.63 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.616 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.434 ' H ' ' HA ' ' A' ' 76' ' ' VAL . 77.5 t80 -60.42 -45.67 92.79 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.689 179.665 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 35.7 p30 -141.98 171.5 13.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.507 -179.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . 0.486 ' O ' ' HB3' ' A' ' 95' ' ' ALA . 54.9 p -96.83 -7.23 34.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.564 -179.854 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . 0.606 ' CG ' ' CE1' ' B' ' 223' ' ' HIS . 61.4 m80 -41.85 -61.45 1.11 Allowed 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.033 0.444 . . . . 0.0 110.637 179.734 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 69.1 t -53.88 -41.04 47.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.788 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.486 ' HB3' ' O ' ' A' ' 92' ' ' THR . . . -56.84 -43.51 81.17 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.346 179.79 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 90.6 mt-30 -62.27 -45.4 93.46 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 121.153 0.502 . . . . 0.0 110.132 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 13.6 tp -56.84 -44.38 82.04 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.007 -179.332 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 92.9 mt -64.13 -37.12 86.3 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.01 179.546 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 46.3 t0 -56.47 -45.62 80.8 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.107 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.463 ' OE2' ' OE2' ' B' ' 219' ' ' GLU . 91.7 mt-10 -67.52 -52.09 43.16 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.604 179.382 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -52.74 -46.39 67.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.057 179.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 5.2 mm -63.39 -44.25 98.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 121.132 0.491 . . . . 0.0 110.71 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -60.65 -46.19 91.26 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.254 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' HIS . . . . . 0.61 ' CE1' ' CG ' ' B' ' 212' ' ' HIS . 68.2 t60 -65.29 -36.81 85.21 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.465 179.733 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 47.2 t -59.48 -46.59 88.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.333 -179.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 77.9 tt0 -74.7 -60.55 2.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.075 0.464 . . . . 0.0 110.807 179.333 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 85.6 t60 . . . . . 0 CA--C 1.515 -0.375 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.913 -179.574 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 135' ' ' ASP . . . . . 0.52 ' O ' ' N ' ' B' ' 138' ' ' ALA . 97.9 m-20 . . . . . 0 CA--C 1.523 -0.061 0 CA-C-O 120.474 0.178 . . . . 0.0 110.631 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 92.8 p -38.43 -40.08 0.52 Allowed 'General case' 0 C--O 1.236 0.352 0 CA-C-O 121.27 0.557 . . . . 0.0 110.403 -179.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 95.9 mm-40 -65.66 -43.27 89.91 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.172 179.175 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 138' ' ' ALA . . . . . 0.52 ' N ' ' O ' ' B' ' 135' ' ' ASP . . . -64.81 -29.1 70.05 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.489 179.44 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.83 -52.43 30.02 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.338 179.734 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -60.47 -50.14 74.76 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.929 0.395 . . . . 0.0 111.172 179.592 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 68.1 tp60 -53.92 -49.55 68.4 Favored 'General case' 0 C--O 1.243 0.72 0 CA-C-O 121.591 0.71 . . . . 0.0 110.019 -179.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 142' ' ' VAL . . . . . 0.432 HG23 ' O ' ' B' ' 138' ' ' ALA . 53.4 t -62.21 -42.71 96.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.784 179.38 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 143' ' ' ALA . . . . . 0.438 ' HB2' HD12 ' A' ' 36' ' ' LEU . . . -50.24 -46.76 55.07 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.011 179.648 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 11.3 t -59.99 -44.51 94.48 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.155 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 19.8 m -63.75 -51.36 65.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.265 0.555 . . . . 0.0 111.049 179.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 92.5 mt -67.75 -21.1 65.29 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.909 -179.572 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 147' ' ' GLN . . . . . 0.41 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 53.2 tt0 -75.34 -59.37 2.77 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.728 179.417 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 148' ' ' ALA . . . . . 0.486 ' HB1' ' NH1' ' B' ' 154' ' ' ARG . . . -59.02 -53.69 55.56 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.049 -179.159 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.441 ' O ' ' C ' ' B' ' 150' ' ' ALA . 4.0 mm? -50.86 -41.95 58.37 Favored 'General case' 0 CA--C 1.509 -0.599 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 -178.304 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 150' ' ' ALA . . . . . 0.553 ' O ' ' C ' ' B' ' 151' ' ' THR . . . -38.91 -72.18 0.07 Allowed 'General case' 0 CA--C 1.511 -0.555 0 O-C-N 123.519 0.512 . . . . 0.0 110.334 179.719 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 151' ' ' THR . . . . . 0.553 ' C ' ' O ' ' B' ' 150' ' ' ALA . 6.5 p -1.77 105.74 0.02 OUTLIER Pre-proline 0 N--CA 1.478 0.948 0 O-C-N 124.428 1.08 . . . . 0.0 111.088 -179.839 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo -46.32 -48.73 12.77 Favored 'Trans proline' 0 C--N 1.307 -1.648 0 C-N-CA 122.053 1.836 . . . . 0.0 113.154 -177.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 11.3 t -57.2 -43.99 83.22 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.722 -179.214 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 154' ' ' ARG . . . . . 0.486 ' NH1' ' HB1' ' B' ' 148' ' ' ALA . 38.7 ttm180 -62.42 -43.86 97.82 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.592 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 155' ' ' LEU . . . . . 0.518 ' O ' HG23 ' B' ' 159' ' ' THR . 31.5 mt -58.4 -51.5 69.57 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.424 -0.511 . . . . 0.0 110.718 -179.561 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 156' ' ' MET . . . . . 0.401 ' O ' ' OG1' ' B' ' 159' ' ' THR . 51.9 ttp -55.44 -45.65 76.81 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 120.267 -0.573 . . . . 0.0 110.596 179.727 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 97.0 mt -62.65 -47.4 93.08 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 CA-C-O 121.378 0.609 . . . . 0.0 110.87 -179.514 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -62.53 -41.31 98.79 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.602 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 159' ' ' THR . . . . . 0.518 HG23 ' O ' ' B' ' 155' ' ' LEU . 31.3 p -62.47 -32.77 73.71 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.064 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 59.2 tp60 -64.93 -50.17 67.51 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.223 -0.444 . . . . 0.0 109.949 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 161' ' ' LEU . . . . . 0.429 ' O ' ' N ' ' B' ' 164' ' ' GLY . 17.0 mt -62.49 -31.75 72.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.584 179.776 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 162' ' ' ARG . . . . . . . . . . . . . 11.2 ttm180 -40.82 -41.47 1.58 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.618 -179.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -62.33 -42.25 99.23 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.316 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 164' ' ' GLY . . . . . 0.429 ' N ' ' O ' ' B' ' 161' ' ' LEU . . . 161.03 178.58 35.13 Favored Glycine 0 CA--C 1.527 0.785 0 C-N-CA 120.672 -0.775 . . . . 0.0 111.331 179.086 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_exo -67.74 147.94 76.44 Favored 'Trans proline' 0 N--CA 1.49 1.272 0 C-N-CA 122.836 2.357 . . . . 0.0 112.028 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 166' ' ' LEU . . . . . 0.577 ' O ' HD12 ' B' ' 166' ' ' LEU . 0.3 OUTLIER -163.76 160.61 17.36 Favored Pre-proline 0 CA--C 1.534 0.359 0 C-N-CA 120.133 -0.627 . . . . 0.0 110.701 178.717 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 16.1 Cg_exo -68.22 149.33 75.98 Favored 'Trans proline' 0 N--CA 1.495 1.583 0 C-N-CA 122.525 2.15 . . . . 0.0 112.119 178.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 168' ' ' VAL . . . . . 0.456 HG23 ' N ' ' B' ' 169' ' ' THR . 4.5 m -64.54 -40.0 87.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 121.819 0.818 . . . . 0.0 110.728 179.143 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 169' ' ' THR . . . . . 0.456 ' N ' HG23 ' B' ' 168' ' ' VAL . 7.0 m -55.87 -66.5 0.41 Allowed 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 114.702 -1.135 . . . . 0.0 110.496 179.381 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 93.2 m-20 -50.35 -39.91 47.65 Favored 'General case' 0 C--O 1.239 0.546 0 CA-C-O 121.326 0.584 . . . . 0.0 109.687 -179.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 171' ' ' LEU . . . . . 0.596 HD23 ' O ' ' B' ' 171' ' ' LEU . 1.5 tt -58.99 -42.5 90.18 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.379 -0.601 . . . . 0.0 109.379 -179.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 172' ' ' ALA . . . . . 0.539 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -64.37 -42.63 96.08 Favored 'General case' 0 N--CA 1.446 -0.675 0 C-N-CA 120.826 -0.35 . . . . 0.0 110.18 179.575 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -53.92 -34.51 59.78 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.099 -0.5 . . . . 0.0 109.695 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -71.97 -38.22 69.77 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.574 178.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 96.7 mt -88.55 -69.43 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.519 -0.246 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.296 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 176' ' ' GLY . . . . . 0.539 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 148.98 70.43 0.01 OUTLIER Glycine 0 CA--C 1.522 0.5 0 N-CA-C 111.518 -0.633 . . . . 0.0 111.518 179.654 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 3.9 mmt 58.71 78.46 0.25 Allowed 'General case' 0 N--CA 1.462 0.148 0 CA-C-O 120.782 0.325 . . . . 0.0 110.807 179.282 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 86.3 mt-10 -150.55 20.15 0.82 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.8 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -61.69 -29.96 70.43 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.056 0.455 . . . . 0.0 110.29 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 6.9 t -65.57 -43.38 89.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.529 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -62.31 -30.81 71.41 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.177 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 83.9 t -71.0 -50.36 43.17 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.185 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.591 179.497 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 42.9 t -57.37 -41.74 80.74 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.928 0.394 . . . . 0.0 110.336 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 19.5 t60 -61.64 -51.0 70.27 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.212 0.53 . . . . 0.0 110.51 179.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 36.4 mt-30 -62.65 -32.81 73.92 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.015 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 186' ' ' LEU . . . . . 0.436 HD21 HH21 ' B' ' 190' ' ' ARG . 2.7 tp -63.27 -44.12 96.02 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.1 179.876 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -62.63 -41.88 99.28 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 120.729 -0.388 . . . . 0.0 110.31 -179.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 98.1 t -62.58 -54.13 38.0 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 C-N-CA 119.974 -0.69 . . . . 0.0 110.351 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 12.6 mt -60.73 -40.35 92.01 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.08 0.466 . . . . 0.0 110.049 -179.479 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 190' ' ' ARG . . . . . 0.436 HH21 HD21 ' B' ' 186' ' ' LEU . 62.7 ttm-85 -55.15 -41.68 72.12 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.025 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 92.1 m-20 -59.69 -46.82 87.92 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.439 -0.504 . . . . 0.0 110.281 -179.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 192' ' ' LEU . . . . . . . . . . . . . 9.7 mt -67.11 -39.75 86.74 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.953 0.406 . . . . 0.0 110.417 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 97.54 88.79 1.88 Allowed Glycine 0 N--CA 1.463 0.474 0 N-CA-C 110.765 -0.934 . . . . 0.0 110.765 -179.651 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 4.7 tp -152.45 -13.64 0.17 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.802 0.334 . . . . 0.0 110.859 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 195' ' ' VAL . . . . . 0.429 ' HA ' ' H ' ' B' ' 209' ' ' TYR . 27.7 m -135.02 158.64 41.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 109.832 -0.432 . . . . 0.0 109.832 -179.697 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 196' ' ' VAL . . . . . 0.665 HG12 ' N ' ' B' ' 197' ' ' GLY . 64.7 t -121.8 169.02 13.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.323 -179.688 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 197' ' ' GLY . . . . . 0.665 ' N ' HG12 ' B' ' 196' ' ' VAL . . . -157.33 142.04 8.31 Favored Glycine 0 CA--C 1.525 0.665 0 N-CA-C 110.615 -0.994 . . . . 0.0 110.615 179.471 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 60.4 t0 . . . . . 0 N--CA 1.467 0.411 0 CA-C-O 120.935 0.398 . . . . 0.0 110.559 179.989 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 55.6 t . . . . . 0 N--CA 1.466 0.367 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 206' ' ' TYR . . . . . 0.593 ' N ' ' CD1' ' B' ' 206' ' ' TYR . 0.2 OUTLIER -108.43 135.9 48.94 Favored 'General case' 0 N--CA 1.469 0.485 0 O-C-N 123.58 0.55 . . . . 0.0 109.987 -179.834 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 3.1 m -150.63 171.16 17.57 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 -179.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . 29.5 mt -83.77 143.13 30.19 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.623 -179.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 209' ' ' TYR . . . . . 0.442 ' HA ' HG23 ' B' ' 196' ' ' VAL . 81.0 t80 -60.69 -46.02 91.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.71 179.77 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 43.2 p30 -140.84 172.56 12.52 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.338 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 211' ' ' THR . . . . . 0.472 ' O ' ' HB3' ' B' ' 214' ' ' ALA . 43.5 p -98.37 -7.65 28.42 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.439 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 212' ' ' HIS . . . . . 0.61 ' CG ' ' CE1' ' A' ' 104' ' ' HIS . 60.5 m80 -41.7 -61.33 1.11 Allowed 'General case' 0 C--O 1.233 0.224 0 CA-C-O 120.96 0.41 . . . . 0.0 110.419 179.779 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 92.0 t -53.88 -41.64 49.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.181 -0.463 . . . . 0.0 109.771 -179.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 214' ' ' ALA . . . . . 0.472 ' HB3' ' O ' ' B' ' 211' ' ' THR . . . -56.44 -43.37 79.43 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.368 179.814 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 84.3 mt-30 -62.38 -45.26 93.97 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.072 -179.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 216' ' ' LEU . . . . . . . . . . . . . 12.6 tp -56.61 -44.38 81.1 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.509 -0.477 . . . . 0.0 109.898 -179.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 92.5 mt -63.8 -38.23 90.32 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.093 179.522 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 58.0 t0 -56.05 -45.84 79.09 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.08 -179.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 219' ' ' GLU . . . . . 0.463 ' OE2' ' OE2' ' A' ' 100' ' ' GLU . 93.6 mt-10 -67.66 -51.79 45.67 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.708 -0.397 . . . . 0.0 110.62 179.462 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -53.09 -46.32 68.59 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 179.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 4.8 mm -63.73 -44.08 98.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 121.084 0.469 . . . . 0.0 110.613 -179.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 84.5 t80 -60.58 -45.76 92.76 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.017 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 223' ' ' HIS . . . . . 0.606 ' CE1' ' CG ' ' A' ' 93' ' ' HIS . 68.5 t60 -65.55 -37.01 85.47 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.534 179.641 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 11.5 t -59.12 -46.73 87.58 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.339 -179.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -74.58 -59.8 2.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.09 0.472 . . . . 0.0 110.663 179.348 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 86.1 t60 . . . . . 0 CA--C 1.514 -0.435 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.877 -179.576 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 95.4 m-20 . . . . . 0 CA--C 1.528 0.111 0 CA-C-O 120.696 0.284 . . . . 0.0 110.737 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 12.4 t -45.02 -48.17 11.6 Favored 'General case' 0 C--O 1.239 0.549 0 CA-C-O 121.164 0.507 . . . . 0.0 110.142 179.488 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 9.4 mp0 -64.53 -45.53 86.75 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.125 -0.488 . . . . 0.0 109.895 179.461 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.643 ' O ' HG23 ' A' ' 23' ' ' VAL . . . -56.14 -28.4 57.85 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.189 -0.46 . . . . 0.0 109.872 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.475 ' HB1' ' HB3' ' B' ' 155' ' ' LEU . . . -71.98 -49.54 36.4 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 110.108 -0.33 . . . . 0.0 110.108 179.429 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.03 -44.96 96.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.354 -179.803 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -60.96 -51.62 68.5 Favored 'General case' 0 C--O 1.242 0.671 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.701 -179.507 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.643 HG23 ' O ' ' A' ' 19' ' ' ALA . 98.8 t -60.49 -44.28 96.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.967 179.744 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.69 -42.14 78.56 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 120.804 -0.358 . . . . 0.0 110.201 179.525 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.2 m -59.2 -43.86 92.23 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.309 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.475 ' OG1' ' O ' ' A' ' 23' ' ' VAL . 30.6 p -64.83 -52.24 57.78 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 120.833 -0.347 . . . . 0.0 110.635 179.872 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.414 ' N ' ' CD1' ' A' ' 27' ' ' LEU . 7.6 mp -63.17 -21.58 66.3 Favored 'General case' 0 C--O 1.223 -0.295 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.787 179.493 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.553 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 64.0 tt0 -74.31 -59.91 2.51 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.688 179.391 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.62 -54.63 44.88 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.518 -179.478 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.505 ' O ' ' O ' ' A' ' 31' ' ' ALA . 8.5 mp -47.79 -32.42 5.99 Favored 'General case' 0 CA--C 1.515 -0.393 0 C-N-CA 120.956 -0.298 . . . . 0.0 110.387 -179.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.553 ' HB3' ' O ' ' A' ' 28' ' ' GLN . . . -56.84 -139.04 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.459 0 O-C-N 123.51 0.506 . . . . 0.0 110.247 179.711 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.485 ' O ' ' O ' ' A' ' 31' ' ' ALA . 7.1 m 56.54 117.35 0.01 OUTLIER Pre-proline 0 C--N 1.32 -0.695 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.347 179.659 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -48.37 -47.83 18.89 Favored 'Trans proline' 0 C--N 1.308 -1.561 0 C-N-CA 122.311 2.008 . . . . 0.0 112.824 -178.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 77.8 p -58.15 -48.71 79.42 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.977 -178.467 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.1 mmp_? -68.15 -36.58 79.9 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.584 179.893 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.518 HD13 ' O ' ' A' ' 36' ' ' LEU . 0.2 OUTLIER -61.34 -53.45 56.55 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.468 -0.493 . . . . 0.0 110.687 -178.367 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.453 ' C ' ' SD ' ' A' ' 37' ' ' MET . 0.9 OUTLIER -60.73 -45.77 93.0 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.473 179.967 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 86.8 mt -61.18 -43.56 96.62 Favored 'Isoleucine or valine' 0 C--O 1.242 0.66 0 CA-C-O 121.258 0.552 . . . . 0.0 110.394 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 34.5 mt -62.06 -40.59 96.29 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.519 179.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 99.0 m -59.92 -42.25 93.53 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.912 179.703 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.451 ' NE2' ' SD ' ' A' ' 37' ' ' MET . 45.7 mt-30 -58.23 -44.12 88.08 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.132 179.715 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.536 HD22 ' O ' ' A' ' 87' ' ' TYR . 19.4 mt -63.79 -42.92 97.65 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.897 178.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.518 HH12 ' C ' ' A' ' 98' ' ' LEU . 59.0 ttp180 -62.69 -35.88 81.12 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.323 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 14.3 t-20 -57.82 -41.42 82.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.607 -178.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 163.36 -175.96 39.58 Favored Glycine 0 CA--C 1.526 0.762 0 N-CA-C 110.972 -0.851 . . . . 0.0 110.972 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -74.58 135.03 19.35 Favored 'Trans proline' 0 N--CA 1.495 1.603 0 C-N-CA 122.812 2.341 . . . . 0.0 112.075 -179.533 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -157.02 98.82 2.01 Favored Pre-proline 0 CA--C 1.54 0.585 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.265 -178.833 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_exo -47.12 165.05 0.1 Allowed 'Trans proline' 0 C--N 1.301 -1.934 0 C-N-CA 122.321 2.014 . . . . 0.0 112.554 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 75.1 t -48.6 -43.48 13.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.693 -179.776 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 47.3 p -61.25 -39.86 91.91 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.504 179.569 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -64.71 -38.2 90.2 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.003 179.769 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.617 ' O ' HD13 ' A' ' 52' ' ' LEU . 0.2 OUTLIER -62.5 -46.84 86.62 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 120.42 -0.512 . . . . 0.0 110.223 179.811 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.525 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -55.18 -47.2 75.56 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.657 179.558 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 48.9 tp10 -55.38 -50.41 69.78 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.168 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.08 -58.22 7.21 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.767 -179.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 98.4 mt -85.7 -73.69 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.444 179.786 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . 0.525 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 131.62 94.51 0.63 Allowed Glycine 0 N--CA 1.461 0.358 0 N-CA-C 111.163 -0.775 . . . . 0.0 111.163 179.695 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 84.6 mmm 67.54 84.27 0.16 Allowed 'General case' 0 CA--C 1.521 -0.161 0 CA-C-O 120.829 0.347 . . . . 0.0 111.025 178.593 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 15.2 tt0 -169.32 28.15 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.275 179.588 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -66.45 -23.83 66.34 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.78 -179.335 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 15.5 t -66.06 -44.46 84.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.132 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.531 ' O ' ' NE2' ' A' ' 66' ' ' GLN . . . -63.4 -31.98 73.28 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.327 -179.695 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 60.2 t -72.6 -53.81 18.04 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.242 0 C-N-CA 120.746 -0.382 . . . . 0.0 110.647 -179.457 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 79.7 p -58.13 -40.3 80.94 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.909 -0.317 . . . . 0.0 110.165 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' HIS . . . . . 0.41 ' ND1' ' OE1' ' A' ' 66' ' ' GLN . 50.4 t-80 -65.86 -51.21 60.74 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.087 0.47 . . . . 0.0 110.845 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . 0.531 ' NE2' ' O ' ' A' ' 62' ' ' ALA . 0.7 OUTLIER -61.9 -39.55 92.35 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.287 179.765 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.497 HD21 ' CE1' ' A' ' 87' ' ' TYR . 23.6 tp -61.8 -44.3 97.14 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.236 -179.49 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 21.0 mmt85 -61.67 -41.64 97.83 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 120.795 0.331 . . . . 0.0 110.516 -179.376 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.404 HG23 ' O ' ' A' ' 65' ' ' HIS . 94.0 t -61.2 -55.01 27.48 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.222 0 C-N-CA 120.224 -0.59 . . . . 0.0 110.262 -179.522 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 10.5 mp -62.0 -39.57 92.68 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 179.392 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 78.1 ttt-85 -51.96 -42.67 63.07 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.003 -179.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -60.63 -45.57 93.54 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.638 -0.425 . . . . 0.0 110.25 179.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.8 mt -65.84 -38.71 89.59 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.134 179.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 91.33 32.75 8.53 Favored Glycine 0 CA--C 1.522 0.522 0 N-CA-C 110.905 -0.878 . . . . 0.0 110.905 -179.534 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 91.2 mt -95.85 -1.33 49.71 Favored 'General case' 0 CA--C 1.519 -0.232 0 O-C-N 122.86 -0.2 . . . . 0.0 110.597 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.402 ' HA ' ' H ' ' A' ' 90' ' ' TYR . 26.8 m -134.28 155.97 39.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.191 -179.877 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 73.0 t -124.95 137.61 56.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.146 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -119.89 129.87 8.17 Favored Glycine 0 N--CA 1.465 0.589 0 N-CA-C 110.734 -0.946 . . . . 0.0 110.734 179.353 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 12.9 t70 . . . . . 0 N--CA 1.465 0.319 0 N-CA-C 110.304 -0.258 . . . . 0.0 110.304 -179.8 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 99.5 t . . . . . 0 N--CA 1.463 0.217 0 CA-C-O 120.956 0.407 . . . . 0.0 110.577 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.536 ' O ' HD22 ' A' ' 42' ' ' LEU . 65.4 m-85 -98.62 125.2 43.81 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.133 179.768 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 86.7 p -142.24 160.62 39.89 Favored 'General case' 0 C--O 1.224 -0.271 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.438 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 7.3 mt -72.73 136.69 45.57 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.633 -179.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.468 ' CD1' ' C ' ' A' ' 90' ' ' TYR . 20.8 t80 -62.59 -51.52 67.0 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.743 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.5 m-20 -83.58 143.06 30.4 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.526 -179.409 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 98.9 m -94.21 -25.82 16.92 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.357 179.091 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . 0.62 ' CG ' ' ND1' ' B' ' 223' ' ' HIS . 77.9 m-70 -58.23 -44.04 88.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.363 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.531 HG23 ' N ' ' A' ' 95' ' ' ALA . 20.0 m -56.04 -42.01 70.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.021 -179.862 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.531 ' N ' HG23 ' A' ' 94' ' ' VAL . . . -60.88 -45.97 92.46 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.997 0.427 . . . . 0.0 110.28 179.035 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 67.1 tp60 -62.04 -41.52 98.21 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.106 179.34 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.423 HD11 ' HG ' ' B' ' 216' ' ' LEU . 11.3 tp -58.56 -44.4 89.7 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.22 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.518 ' C ' HH12 ' A' ' 43' ' ' ARG . 87.1 mt -63.24 -39.54 94.91 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.227 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . 0.494 ' N ' ' NH1' ' A' ' 43' ' ' ARG . 52.1 m-20 -59.36 -41.24 88.82 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.747 0.308 . . . . 0.0 110.527 -179.481 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -69.53 -54.41 14.28 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.993 179.456 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.12 -43.23 91.94 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.443 -179.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.401 ' CG1' ' O ' ' A' ' 98' ' ' LEU . 4.1 mm -61.68 -45.54 98.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.328 -179.283 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 87.7 t80 -60.2 -39.7 87.47 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.865 0.365 . . . . 0.0 110.275 179.594 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' HIS . . . . . 0.574 ' ND1' ' CG ' ' B' ' 212' ' ' HIS . 57.6 t60 -63.76 -39.34 94.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.747 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 29.8 t -75.7 -42.8 49.91 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.895 179.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 11.6 tm-20 -60.08 -37.86 81.17 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.495 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 82.2 t60 . . . . . 0 CA--C 1.508 -0.647 0 CA-C-N 116.114 -0.493 . . . . 0.0 109.887 -179.048 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 94.3 m-20 . . . . . 0 N--CA 1.462 0.172 0 CA-C-O 120.797 0.332 . . . . 0.0 110.646 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 44.1 t -44.32 -49.31 9.53 Favored 'General case' 0 C--O 1.241 0.622 0 CA-C-O 121.088 0.47 . . . . 0.0 110.356 179.265 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 9.5 mp0 -64.19 -45.29 88.99 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.058 179.543 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 138' ' ' ALA . . . . . 0.631 ' O ' HG23 ' B' ' 142' ' ' VAL . . . -56.3 -28.65 59.49 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.189 -0.459 . . . . 0.0 109.872 179.849 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -71.66 -49.93 35.24 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 179.569 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -60.74 -45.48 94.12 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.338 -179.876 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -60.44 -51.56 68.94 Favored 'General case' 0 C--O 1.24 0.583 0 CA-C-O 121.134 0.492 . . . . 0.0 110.652 -179.361 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 142' ' ' VAL . . . . . 0.631 HG23 ' O ' ' B' ' 138' ' ' ALA . 95.1 t -60.42 -44.24 95.76 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.308 0 CA-C-N 115.888 -0.597 . . . . 0.0 109.993 179.786 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -56.86 -42.13 79.19 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.733 0.301 . . . . 0.0 110.274 179.69 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 70.4 m -59.08 -44.38 91.88 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.377 -179.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 145' ' ' THR . . . . . 0.48 ' OG1' ' O ' ' B' ' 142' ' ' VAL . 35.4 p -64.33 -51.37 63.73 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.702 179.753 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 146' ' ' LEU . . . . . 0.403 ' N ' ' CD1' ' B' ' 146' ' ' LEU . 7.6 mp -63.68 -21.51 66.42 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.805 179.502 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 147' ' ' GLN . . . . . 0.568 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 57.7 tt0 -74.68 -59.59 2.66 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.709 179.418 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -58.33 -54.77 43.2 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.685 -179.476 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.478 ' O ' ' O ' ' B' ' 150' ' ' ALA . 8.7 mp -48.42 -30.57 5.19 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.914 -0.314 . . . . 0.0 110.392 -179.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 150' ' ' ALA . . . . . 0.568 ' HB3' ' O ' ' B' ' 147' ' ' GLN . . . -58.08 -138.33 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.456 0 O-C-N 123.611 0.569 . . . . 0.0 110.144 179.702 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 151' ' ' THR . . . . . 0.482 ' O ' ' O ' ' B' ' 150' ' ' ALA . 27.2 m 56.1 117.37 0.01 OUTLIER Pre-proline 0 C--N 1.323 -0.557 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.438 179.636 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -48.25 -47.83 18.61 Favored 'Trans proline' 0 C--N 1.307 -1.624 0 C-N-CA 122.281 1.988 . . . . 0.0 112.901 -179.115 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 77.4 p -58.18 -48.92 78.81 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.933 -178.435 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 154' ' ' ARG . . . . . 0.412 HH21 HG21 ' B' ' 157' ' ' ILE . 1.1 mmp_? -67.39 -37.04 82.51 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.598 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 155' ' ' LEU . . . . . 0.515 ' O ' HD13 ' B' ' 155' ' ' LEU . 0.2 OUTLIER -60.24 -53.19 60.63 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.399 -0.52 . . . . 0.0 110.714 -178.347 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 156' ' ' MET . . . . . 0.457 ' C ' ' SD ' ' B' ' 156' ' ' MET . 1.0 OUTLIER -61.15 -45.65 93.77 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.452 179.981 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 157' ' ' ILE . . . . . 0.412 HG21 HH21 ' B' ' 154' ' ' ARG . 92.6 mt -60.93 -43.75 96.51 Favored 'Isoleucine or valine' 0 C--O 1.242 0.667 0 CA-C-O 121.227 0.537 . . . . 0.0 110.434 -179.616 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 17.0 mt -62.29 -40.13 95.27 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.395 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 19.7 m -59.87 -43.2 94.84 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.158 179.551 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 160' ' ' GLN . . . . . 0.446 ' NE2' ' SD ' ' B' ' 156' ' ' MET . 45.0 mt-30 -57.9 -44.25 86.64 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.077 179.72 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 161' ' ' LEU . . . . . 0.53 HD22 ' O ' ' B' ' 206' ' ' TYR . 20.0 mt -63.95 -42.89 97.17 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.915 179.02 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 162' ' ' ARG . . . . . 0.53 HH12 ' C ' ' B' ' 217' ' ' LEU . 58.7 ttp180 -62.9 -35.45 80.09 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.253 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 17.1 t-20 -58.19 -44.61 88.16 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.747 -178.649 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . 167.46 -174.86 42.6 Favored Glycine 0 CA--C 1.526 0.777 0 N-CA-C 110.989 -0.844 . . . . 0.0 110.989 179.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -75.51 133.23 15.61 Favored 'Trans proline' 0 N--CA 1.494 1.543 0 C-N-CA 122.839 2.359 . . . . 0.0 111.997 -179.728 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -155.41 99.08 2.3 Favored Pre-proline 0 CA--C 1.539 0.555 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.275 -178.882 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_exo -47.56 165.28 0.12 Allowed 'Trans proline' 0 C--N 1.3 -2.015 0 C-N-CA 122.45 2.1 . . . . 0.0 112.411 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . 87.5 t -48.75 -43.4 14.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.68 -179.683 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 169' ' ' THR . . . . . . . . . . . . . 63.4 p -61.45 -39.52 91.14 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.446 179.613 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.83 -38.63 91.64 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.151 179.516 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 171' ' ' LEU . . . . . 0.607 ' O ' HD13 ' B' ' 171' ' ' LEU . 0.2 OUTLIER -62.29 -46.56 88.21 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 120.309 -0.556 . . . . 0.0 110.149 179.771 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 172' ' ' ALA . . . . . 0.55 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -55.45 -47.18 76.46 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 179.435 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 43.8 tp10 -55.43 -50.56 69.48 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.424 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -52.0 -57.22 10.12 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 120.81 -0.356 . . . . 0.0 110.774 -179.592 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 175' ' ' ILE . . . . . 0.452 HD13 ' OE1' ' B' ' 178' ' ' GLU . 99.1 mt -87.1 -70.99 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.522 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 176' ' ' GLY . . . . . 0.55 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 128.14 94.36 0.81 Allowed Glycine 0 N--CA 1.461 0.357 0 N-CA-C 111.136 -0.786 . . . . 0.0 111.136 179.696 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 83.8 mmm 68.96 86.46 0.13 Allowed 'General case' 0 C--N 1.34 0.189 0 C-N-CA 120.899 -0.32 . . . . 0.0 110.981 178.388 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 178' ' ' GLU . . . . . 0.46 ' HG2' ' HB3' ' B' ' 181' ' ' ALA . 47.3 tt0 -172.53 28.01 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.193 179.306 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 72.5 mt-30 -66.75 -23.8 66.13 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.762 -179.531 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 11.9 t -66.53 -44.12 83.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.028 -179.721 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 181' ' ' ALA . . . . . 0.522 ' O ' ' NE2' ' B' ' 185' ' ' GLN . . . -63.7 -32.39 73.86 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.482 -179.765 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 65.0 t -71.94 -53.56 19.73 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 C-N-CA 120.664 -0.414 . . . . 0.0 110.655 -179.314 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 77.5 p -58.36 -39.92 80.85 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.91 -0.316 . . . . 0.0 110.247 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 184' ' ' HIS . . . . . 0.4 ' ND1' ' OE1' ' B' ' 185' ' ' GLN . 49.6 t-80 -65.68 -51.11 62.0 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.714 179.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 185' ' ' GLN . . . . . 0.522 ' NE2' ' O ' ' B' ' 181' ' ' ALA . 0.8 OUTLIER -62.23 -40.62 96.73 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.36 179.835 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 186' ' ' LEU . . . . . 0.434 HD21 ' CE1' ' B' ' 206' ' ' TYR . 17.5 tp -60.67 -44.61 96.28 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.105 -179.651 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 21.5 mmt85 -60.99 -41.84 97.26 Favored 'General case' 0 C--O 1.24 0.563 0 CA-C-O 120.81 0.338 . . . . 0.0 110.546 -179.513 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 87.9 t -61.14 -54.93 28.51 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.177 0 C-N-CA 120.25 -0.58 . . . . 0.0 110.19 -179.517 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 10.5 mp -62.0 -39.68 93.08 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 110.152 -0.314 . . . . 0.0 110.152 179.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 77.1 ttt-85 -51.48 -42.9 61.96 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.03 -179.488 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 55.4 t30 -60.57 -45.57 93.43 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.461 179.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 192' ' ' LEU . . . . . . . . . . . . . 10.1 mt -65.26 -39.36 92.53 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.196 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 91.6 33.2 8.09 Favored Glycine 0 CA--C 1.524 0.61 0 N-CA-C 110.821 -0.912 . . . . 0.0 110.821 -179.62 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 77.8 mt -97.33 -0.74 45.94 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.513 0.197 . . . . 0.0 110.632 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 24.9 m -134.26 155.58 39.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.263 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 196' ' ' VAL . . . . . . . . . . . . . 76.1 t -125.57 138.98 52.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.128 -179.876 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 197' ' ' GLY . . . . . . . . . . . . . . . -121.65 130.66 8.19 Favored Glycine 0 N--CA 1.464 0.548 0 N-CA-C 110.823 -0.911 . . . . 0.0 110.823 179.697 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 13.1 t70 . . . . . 0 N--CA 1.465 0.287 0 N-CA-C 110.305 -0.257 . . . . 0.0 110.305 -179.813 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 89.5 t . . . . . 0 N--CA 1.462 0.17 0 CA-C-O 120.898 0.38 . . . . 0.0 110.609 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 206' ' ' TYR . . . . . 0.53 ' O ' HD22 ' B' ' 161' ' ' LEU . 68.6 m-85 -98.18 125.36 43.19 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.309 179.819 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 34.2 p -142.68 160.69 39.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.335 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . 6.0 mt -73.17 138.07 45.47 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.751 -179.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 209' ' ' TYR . . . . . 0.461 ' C ' ' CD1' ' B' ' 209' ' ' TYR . 22.3 t80 -63.46 -52.39 61.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.801 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 43.1 m-20 -82.7 142.5 31.61 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.474 -179.339 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 99.3 m -94.6 -24.06 17.37 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-O 121.068 0.461 . . . . 0.0 110.33 179.223 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 212' ' ' HIS . . . . . 0.574 ' CG ' ' ND1' ' A' ' 104' ' ' HIS . 85.6 m-70 -59.5 -43.79 93.27 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.211 179.755 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 213' ' ' VAL . . . . . 0.554 HG23 ' N ' ' B' ' 214' ' ' ALA . 15.5 m -56.1 -42.77 73.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.021 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 214' ' ' ALA . . . . . 0.554 ' N ' HG23 ' B' ' 213' ' ' VAL . . . -59.9 -46.41 89.44 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.188 179.013 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 68.4 tp60 -61.36 -41.15 96.6 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.019 179.497 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 216' ' ' LEU . . . . . 0.423 ' HG ' HD11 ' A' ' 97' ' ' LEU . 10.0 tp -59.04 -43.99 91.71 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.268 -179.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 217' ' ' LEU . . . . . 0.53 ' C ' HH12 ' B' ' 162' ' ' ARG . 91.3 mt -63.51 -38.96 93.14 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.229 179.709 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 218' ' ' ASP . . . . . 0.478 ' N ' ' NH1' ' B' ' 162' ' ' ARG . 69.3 m-20 -59.66 -41.55 90.84 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.889 0.376 . . . . 0.0 110.603 -179.52 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 219' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -69.52 -54.92 11.81 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.984 179.581 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -58.15 -43.76 87.55 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.4 -179.686 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 221' ' ' ILE . . . . . 0.414 ' CG1' ' O ' ' B' ' 217' ' ' LEU . 4.1 mm -61.47 -45.91 97.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.388 -178.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 86.5 t80 -60.94 -40.14 92.13 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.244 179.757 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 223' ' ' HIS . . . . . 0.62 ' ND1' ' CG ' ' A' ' 93' ' ' HIS . 41.4 t60 -61.5 -41.92 98.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.032 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 35.6 t -73.63 -40.79 63.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.013 179.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 11.4 tm-20 -65.29 -31.38 72.49 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.708 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 226' ' ' HIS . . . . . 0.524 ' O ' ' CD2' ' B' ' 226' ' ' HIS . 76.2 t60 . . . . . 0 C--N 1.325 -0.457 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.689 -179.52 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 93.7 m-20 . . . . . 0 C--O 1.224 -0.267 0 CA-C-O 120.46 0.171 . . . . 0.0 110.7 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 47.6 t -38.74 -49.91 1.62 Allowed 'General case' 0 C--O 1.239 0.518 0 CA-C-O 121.383 0.611 . . . . 0.0 110.606 -179.661 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.408 ' HG2' ' H ' ' A' ' 18' ' ' GLN . 3.0 pt20 -64.64 -46.43 82.57 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.003 179.319 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.632 ' O ' HG23 ' A' ' 23' ' ' VAL . . . -58.43 -28.65 65.46 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.221 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.464 ' HB1' ' HB3' ' B' ' 155' ' ' LEU . . . -70.97 -51.0 28.23 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 120.888 0.375 . . . . 0.0 110.128 179.834 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.49 -40.53 96.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.557 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.468 HE22 HG23 ' A' ' 26' ' ' THR . 5.4 tm0? -62.31 -50.43 71.67 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-O 121.417 0.627 . . . . 0.0 110.444 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.632 HG23 ' O ' ' A' ' 19' ' ' ALA . 93.9 t -61.74 -43.36 97.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.98 179.712 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.71 -41.4 81.67 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 58.9 m -59.47 -45.25 92.16 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.154 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.468 HG23 HE22 ' A' ' 22' ' ' GLN . 22.6 p -63.99 -44.58 92.26 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-O 120.937 0.398 . . . . 0.0 110.442 179.551 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 95.9 mt -67.13 -21.73 65.83 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.332 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.49 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 60.1 tt0 -74.49 -58.18 3.45 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.274 179.71 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.98 -55.19 31.9 Favored 'General case' 0 CA--C 1.52 -0.205 0 C-N-CA 120.511 -0.476 . . . . 0.0 110.276 -179.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.487 ' O ' ' O ' ' A' ' 31' ' ' ALA . 50.3 tp -43.94 -32.34 1.1 Allowed 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 110.12 -0.326 . . . . 0.0 110.12 -178.524 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.49 ' HB3' ' O ' ' A' ' 28' ' ' GLN . . . -58.24 -136.2 0.0 OUTLIER 'General case' 0 C--O 1.218 -0.6 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.84 178.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.453 ' O ' ' O ' ' A' ' 31' ' ' ALA . 9.4 m 55.12 113.15 0.02 OUTLIER Pre-proline 0 CA--C 1.538 0.488 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.836 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_exo -47.84 -45.77 23.45 Favored 'Trans proline' 0 C--N 1.309 -1.505 0 C-N-CA 122.395 2.064 . . . . 0.0 113.247 -179.211 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 51.7 m -54.14 -42.89 70.04 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.132 0.492 . . . . 0.0 111.188 -179.338 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.5 mmp_? -68.39 -34.42 76.01 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.066 179.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.49 ' O ' HG23 ' A' ' 40' ' ' THR . 3.6 mm? -64.55 -56.23 15.39 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.431 -0.508 . . . . 0.0 111.84 -179.025 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.493 ' O ' ' OG1' ' A' ' 40' ' ' THR . 3.3 ptm -58.26 -44.06 88.19 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.092 0.473 . . . . 0.0 110.037 179.752 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 92.4 mt -64.02 -43.9 97.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 121.492 0.663 . . . . 0.0 110.144 179.11 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.483 HD11 HD21 ' A' ' 89' ' ' LEU . 64.0 tp -59.51 -41.17 89.31 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.927 -179.575 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.493 ' OG1' ' O ' ' A' ' 37' ' ' MET . 41.4 p -63.93 -35.78 81.78 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.309 -179.754 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 89.8 mm-40 -63.61 -50.81 67.93 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 120.501 -0.48 . . . . 0.0 110.245 179.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 78.9 mt -63.44 -32.86 74.42 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.666 179.721 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 61.5 ttp180 -53.16 -39.49 63.61 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.197 -179.44 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 43.0 t-20 -61.92 -41.1 97.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.815 0.34 . . . . 0.0 110.593 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 168.5 177.62 39.64 Favored Glycine 0 CA--C 1.527 0.785 0 N-CA-C 111.016 -0.833 . . . . 0.0 111.016 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_endo -69.43 152.38 71.03 Favored 'Trans proline' 0 C--N 1.309 -1.503 0 C-N-CA 122.893 2.395 . . . . 0.0 111.897 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 1.3 pp 178.59 148.28 0.39 Allowed Pre-proline 0 N--CA 1.451 -0.418 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.789 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -72.63 -175.66 1.94 Allowed 'Trans proline' 0 N--CA 1.494 1.547 0 C-N-CA 122.756 2.304 . . . . 0.0 112.208 178.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.765 HG23 ' H ' ' A' ' 50' ' ' THR . 33.1 m -75.79 -61.42 1.7 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.582 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.912 179.471 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.765 ' H ' HG23 ' A' ' 49' ' ' VAL . 71.8 p -29.32 -46.1 0.05 Allowed 'General case' 0 N--CA 1.475 0.801 0 CA-C-O 121.464 0.649 . . . . 0.0 110.362 -179.449 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -62.33 -43.55 98.55 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.099 178.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.695 ' N ' ' O ' ' A' ' 49' ' ' VAL . 0.2 OUTLIER -61.33 -38.62 87.57 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.846 -179.754 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.533 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -61.53 -43.85 98.12 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.635 -0.505 . . . . 0.0 109.635 179.712 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -57.0 -46.48 82.24 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 179.628 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.28 -49.46 77.74 Favored 'General case' 0 C--O 1.231 0.094 0 C-N-CA 120.73 -0.388 . . . . 0.0 110.248 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 96.3 mt -92.7 -79.22 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.346 179.502 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . 0.533 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 141.76 89.73 0.14 Allowed Glycine 0 CA--C 1.519 0.331 0 N-CA-C 111.171 -0.772 . . . . 0.0 111.171 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 32.0 ttp 69.23 105.94 0.06 Allowed 'General case' 0 CA--C 1.52 -0.21 0 CA-C-O 120.53 0.205 . . . . 0.0 110.682 179.261 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 176.05 10.98 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.528 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -53.8 -37.56 63.64 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.705 -179.293 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 4.8 t -61.45 -48.94 78.83 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.951 -179.548 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.4 -35.68 68.05 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.224 -179.748 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 90.2 t -69.42 -52.96 27.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 C-N-CA 120.524 -0.47 . . . . 0.0 110.778 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 78.3 p -56.32 -43.32 78.88 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.876 0.369 . . . . 0.0 110.53 -179.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 55.9 t-80 -63.76 -51.07 66.51 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.019 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -61.04 -38.4 86.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.417 179.708 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.409 HD21 ' CD1' ' A' ' 87' ' ' TYR . 54.4 tp -60.84 -45.35 94.83 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.428 -179.81 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 74.1 ttt180 -60.77 -45.37 94.62 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-O 121.091 0.472 . . . . 0.0 110.509 -179.521 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 91.4 t -65.54 -54.5 27.53 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.386 0 C-N-CA 120.203 -0.599 . . . . 0.0 110.583 -179.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 97.7 mt -56.37 -40.73 75.04 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 -179.435 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 59.1 ttt85 -57.83 -39.64 78.15 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.26 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 97.6 m-20 -62.24 -43.54 98.59 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 120.548 -0.461 . . . . 0.0 110.594 -179.464 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.474 HD23 ' N ' ' A' ' 73' ' ' LEU . 7.0 mt -65.9 -44.72 84.4 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-O 120.953 0.406 . . . . 0.0 110.587 -179.29 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 104.15 96.56 2.41 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 111.612 -0.595 . . . . 0.0 111.612 179.606 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -171.92 -6.11 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.898 0.38 . . . . 0.0 110.654 179.205 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 30.8 m -138.83 157.62 29.52 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.19 179.656 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.423 HG12 ' N ' ' A' ' 78' ' ' GLY . 61.2 t -143.82 155.59 15.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.432 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . 0.423 ' N ' HG12 ' A' ' 77' ' ' VAL . . . -126.41 144.89 15.4 Favored Glycine 0 N--CA 1.462 0.429 0 N-CA-C 110.446 -1.062 . . . . 0.0 110.446 179.378 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 . . . . . 0 N--CA 1.466 0.328 0 N-CA-C 110.349 -0.241 . . . . 0.0 110.349 -179.996 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 20.1 m . . . . . 0 N--CA 1.463 0.209 0 N-CA-C 110.355 -0.239 . . . . 0.0 110.355 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.409 ' CD1' HD21 ' A' ' 67' ' ' LEU . 27.7 m-85 -115.75 136.58 52.91 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.463 -179.66 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 20.1 m -151.07 171.95 16.51 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.193 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.614 ' N ' HD12 ' A' ' 89' ' ' LEU . 8.3 mp -74.8 146.64 41.89 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.494 -179.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 58.6 t80 -52.18 -47.52 65.5 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.493 179.8 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.552 ' CG ' ' H ' ' A' ' 92' ' ' THR . 43.4 t0 -155.4 -177.42 6.54 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.387 -179.799 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . 0.552 ' H ' ' CG ' ' A' ' 91' ' ' ASP . 5.5 t -77.48 6.84 6.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.451 -179.808 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . 0.552 ' CG ' ' CE1' ' B' ' 223' ' ' HIS . 34.9 m80 -62.27 -73.39 0.11 Allowed 'General case' 0 C--O 1.236 0.345 0 CA-C-O 120.976 0.417 . . . . 0.0 110.308 179.889 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 82.4 t -45.22 -40.19 2.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.29 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.46 -39.61 93.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.524 179.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 8.8 tp-100 -60.54 -47.43 86.2 Favored 'General case' 0 C--O 1.241 0.632 0 CA-C-O 121.095 0.474 . . . . 0.0 110.176 -179.412 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.649 HD21 ' HA ' ' B' ' 220' ' ' ALA . 7.2 mp -62.86 -43.28 99.22 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.263 -179.626 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 7.0 tp -63.58 -39.7 95.07 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.029 179.828 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 47.4 t0 -56.48 -47.63 78.82 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.169 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.531 ' N ' ' OE1' ' A' ' 100' ' ' GLU . 0.3 OUTLIER -63.33 -51.56 65.45 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 120.639 -0.425 . . . . 0.0 110.279 179.678 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . 0.665 ' HA ' HD21 ' B' ' 216' ' ' LEU . . . -56.48 -43.01 79.23 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.575 179.893 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 4.1 mm -61.45 -45.6 98.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 C-N-CA 120.512 -0.475 . . . . 0.0 110.502 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 85.1 t80 -61.85 -45.02 95.62 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.981 0.42 . . . . 0.0 110.449 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' HIS . . . . . 0.534 ' CE1' ' CG ' ' B' ' 212' ' ' HIS . 13.9 t60 -55.43 -45.24 76.78 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.601 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 35.3 t -76.07 -33.64 59.56 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.859 179.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 78.7 tt0 -58.88 -38.93 79.94 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.378 -179.471 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 7.6 t60 . . . . . 0 CA--C 1.521 -0.168 0 C-N-CA 120.503 -0.479 . . . . 0.0 110.159 -179.289 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 97.0 m-20 . . . . . 0 C--O 1.224 -0.28 0 CA-C-O 120.505 0.193 . . . . 0.0 110.746 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 27.3 t -39.32 -49.89 1.99 Allowed 'General case' 0 C--O 1.238 0.49 0 CA-C-O 121.439 0.637 . . . . 0.0 110.479 -179.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -64.23 -45.99 85.8 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.902 179.352 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 138' ' ' ALA . . . . . 0.608 ' O ' HG23 ' B' ' 142' ' ' VAL . . . -58.74 -28.27 65.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.419 -179.878 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 139' ' ' ALA . . . . . 0.461 ' HB1' ' HB3' ' A' ' 36' ' ' LEU . . . -71.39 -50.74 29.02 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-O 120.85 0.357 . . . . 0.0 110.168 179.865 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -62.78 -40.95 98.91 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.522 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 4.7 tm0? -61.68 -51.19 69.46 Favored 'General case' 0 C--O 1.24 0.586 0 CA-C-O 121.395 0.617 . . . . 0.0 110.457 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 142' ' ' VAL . . . . . 0.608 HG23 ' O ' ' B' ' 138' ' ' ALA . 85.8 t -61.32 -44.33 98.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.013 179.844 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -56.38 -41.34 76.07 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 62.1 m -59.32 -45.36 91.53 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.178 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 46.9 p -64.0 -44.87 91.34 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.311 179.434 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 96.0 mt -66.4 -22.41 66.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.425 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 147' ' ' GLN . . . . . 0.525 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 59.5 tt0 -74.12 -59.08 2.89 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.29 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -60.78 -55.01 38.18 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 120.571 -0.452 . . . . 0.0 110.308 -179.632 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.475 ' O ' ' O ' ' B' ' 150' ' ' ALA . 47.8 tp -44.31 -31.3 0.99 Allowed 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 120.914 -0.314 . . . . 0.0 110.212 -178.684 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 150' ' ' ALA . . . . . 0.525 ' HB3' ' O ' ' B' ' 147' ' ' GLN . . . -59.16 -135.93 0.0 OUTLIER 'General case' 0 C--O 1.219 -0.524 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.614 179.07 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 151' ' ' THR . . . . . 0.454 ' O ' ' O ' ' B' ' 150' ' ' ALA . 10.1 m 53.97 113.31 0.01 OUTLIER Pre-proline 0 CA--C 1.538 0.505 0 CA-C-N 116.574 -0.284 . . . . 0.0 110.67 179.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -48.68 -46.89 22.63 Favored 'Trans proline' 0 C--N 1.309 -1.503 0 C-N-CA 122.169 1.913 . . . . 0.0 113.209 -178.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 66.8 m -52.91 -38.77 62.18 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.541 0.686 . . . . 0.0 111.052 -179.359 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 154' ' ' ARG . . . . . 0.4 HH11 ' HD3' ' B' ' 154' ' ' ARG . 3.5 mmp_? -71.75 -35.15 70.02 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.993 179.581 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 155' ' ' LEU . . . . . 0.464 ' HB3' ' HB1' ' A' ' 20' ' ' ALA . 3.8 mm? -64.16 -55.77 19.46 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.43 -0.508 . . . . 0.0 111.603 -179.046 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 156' ' ' MET . . . . . 0.432 ' O ' ' OG1' ' B' ' 159' ' ' THR . 0.1 OUTLIER -56.73 -46.26 81.42 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 179.677 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 97.4 mt -62.82 -43.04 98.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 C-N-CA 120.199 -0.6 . . . . 0.0 110.209 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 158' ' ' LEU . . . . . 0.477 HD11 HD21 ' B' ' 208' ' ' LEU . 58.4 tp -60.8 -42.59 97.93 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.287 -179.509 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 159' ' ' THR . . . . . 0.432 ' OG1' ' O ' ' B' ' 156' ' ' MET . 37.1 p -62.37 -35.37 78.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.112 -179.884 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 91.6 mm-40 -65.01 -50.75 65.04 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.965 0.412 . . . . 0.0 110.405 179.434 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 161' ' ' LEU . . . . . . . . . . . . . 82.2 mt -62.61 -32.64 73.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.72 179.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 162' ' ' ARG . . . . . . . . . . . . . 61.8 ttp180 -53.59 -39.04 64.52 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.33 -179.755 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 54.9 t-20 -61.19 -41.11 96.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.945 0.402 . . . . 0.0 110.405 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . 164.55 -176.7 40.38 Favored Glycine 0 CA--C 1.525 0.692 0 N-CA-C 111.12 -0.792 . . . . 0.0 111.12 179.433 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_exo -66.7 150.4 83.6 Favored 'Trans proline' 0 C--N 1.308 -1.6 0 C-N-CA 122.964 2.443 . . . . 0.0 111.937 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 1.7 pp -177.39 146.3 0.63 Allowed Pre-proline 0 N--CA 1.449 -0.509 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.573 178.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -74.53 174.99 11.66 Favored 'Trans proline' 0 N--CA 1.493 1.495 0 C-N-CA 122.873 2.382 . . . . 0.0 112.167 179.546 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . 3.6 m -71.42 -32.77 47.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 121.945 0.879 . . . . 0.0 110.808 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 169' ' ' THR . . . . . . . . . . . . . 50.4 p -58.16 -39.97 80.2 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-N 114.563 -1.199 . . . . 0.0 110.465 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 68.1 m-20 -68.53 -37.97 80.44 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.588 179.625 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 171' ' ' LEU . . . . . 0.627 ' O ' HD13 ' B' ' 171' ' ' LEU . 0.2 OUTLIER -63.76 -38.59 91.66 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.096 -179.365 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 172' ' ' ALA . . . . . 0.517 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -62.81 -46.64 87.01 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.661 179.85 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -56.12 -44.66 79.35 Favored 'General case' 0 C--O 1.232 0.151 0 C-N-CA 120.46 -0.496 . . . . 0.0 109.943 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -59.96 -50.32 74.21 Favored 'General case' 0 C--O 1.231 0.091 0 C-N-CA 120.664 -0.414 . . . . 0.0 110.438 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 97.1 mt -93.35 -78.24 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.187 179.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 176' ' ' GLY . . . . . 0.517 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 142.29 91.62 0.17 Allowed Glycine 0 CA--C 1.519 0.336 0 N-CA-C 111.441 -0.664 . . . . 0.0 111.441 179.779 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 32.7 ttp 66.83 107.6 0.04 OUTLIER 'General case' 0 CA--C 1.518 -0.268 0 CA-C-O 120.66 0.267 . . . . 0.0 110.905 179.169 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 178' ' ' GLU . . . . . 0.423 ' H ' ' H ' ' B' ' 179' ' ' GLN . 1.9 mt-10 174.63 12.43 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.618 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 179' ' ' GLN . . . . . 0.423 ' H ' ' H ' ' B' ' 178' ' ' GLU . 35.3 mt-30 -54.53 -38.14 66.22 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.61 -179.415 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 38.2 m -60.65 -48.29 82.43 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.855 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -57.08 -35.28 69.19 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.129 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 86.2 t -69.89 -53.37 24.31 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.774 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 77.6 p -57.14 -42.14 80.43 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.965 0.412 . . . . 0.0 110.572 -179.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 57.6 t-80 -63.92 -50.7 67.68 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-O 121.054 0.454 . . . . 0.0 110.794 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 85.6 mt-30 -62.3 -38.74 90.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.35 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 186' ' ' LEU . . . . . 0.451 HD21 ' CD1' ' B' ' 206' ' ' TYR . 58.1 tp -60.2 -45.14 94.18 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.219 -179.784 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 75.5 ttt180 -60.84 -44.45 96.95 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-O 121.135 0.493 . . . . 0.0 110.453 -179.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 88.9 t -66.74 -54.21 27.52 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.486 0 C-N-CA 120.121 -0.632 . . . . 0.0 110.709 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 97.7 mt -56.72 -41.32 77.25 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 -179.253 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 59.6 ttt85 -57.96 -39.97 79.42 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.237 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -61.19 -42.53 98.74 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 120.506 -0.478 . . . . 0.0 110.721 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 192' ' ' LEU . . . . . 0.495 HD23 ' N ' ' B' ' 192' ' ' LEU . 6.1 mt -66.96 -42.38 85.3 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.958 0.409 . . . . 0.0 110.5 -179.284 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 101.82 95.47 2.26 Favored Glycine 0 CA--C 1.524 0.647 0 N-CA-C 111.474 -0.65 . . . . 0.0 111.474 179.65 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 194' ' ' LEU . . . . . 0.413 ' H ' ' H ' ' B' ' 195' ' ' VAL . 0.5 OUTLIER -170.71 -7.93 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.924 0.393 . . . . 0.0 110.586 179.139 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 195' ' ' VAL . . . . . 0.413 ' H ' ' H ' ' B' ' 194' ' ' LEU . 22.4 m -136.79 156.11 34.45 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.08 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 196' ' ' VAL . . . . . 0.417 HG12 ' N ' ' B' ' 197' ' ' GLY . 66.5 t -143.53 155.34 16.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.39 -179.909 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 197' ' ' GLY . . . . . 0.417 ' N ' HG12 ' B' ' 196' ' ' VAL . . . -127.03 146.37 16.32 Favored Glycine 0 N--CA 1.463 0.484 0 N-CA-C 110.351 -1.099 . . . . 0.0 110.351 179.519 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 96.6 m-20 . . . . . 0 C--O 1.234 0.264 0 CA-C-O 120.606 0.241 . . . . 0.0 110.489 -179.85 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 23.5 m . . . . . 0 C--O 1.234 0.282 0 CA-C-O 120.69 0.281 . . . . 0.0 110.429 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 206' ' ' TYR . . . . . 0.451 ' CD1' HD21 ' B' ' 186' ' ' LEU . 40.5 m-85 -114.22 137.63 51.53 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.646 -179.51 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 14.9 m -151.75 172.0 16.82 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.343 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 208' ' ' LEU . . . . . 0.615 ' N ' HD12 ' B' ' 208' ' ' LEU . 8.4 mp -75.79 148.11 38.7 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.555 179.763 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 67.5 t80 -52.71 -46.71 67.45 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.358 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 210' ' ' ASP . . . . . 0.518 ' CG ' ' H ' ' B' ' 211' ' ' THR . 43.5 t0 -157.01 -177.4 6.59 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.807 0.337 . . . . 0.0 110.505 -179.827 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 211' ' ' THR . . . . . 0.518 ' H ' ' CG ' ' B' ' 210' ' ' ASP . 4.8 t -77.09 4.77 9.48 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.483 -179.861 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 212' ' ' HIS . . . . . 0.534 ' CG ' ' CE1' ' A' ' 104' ' ' HIS . 35.1 m80 -60.35 -74.72 0.07 Allowed 'General case' 0 C--O 1.237 0.395 0 CA-C-O 121.016 0.436 . . . . 0.0 110.327 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 71.3 t -44.5 -39.82 1.78 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.352 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 214' ' ' ALA . . . . . . . . . . . . . . . -63.26 -39.4 94.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.501 179.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 215' ' ' GLN . . . . . 0.4 ' N ' ' O ' ' B' ' 212' ' ' HIS . 8.8 tp-100 -59.87 -47.51 85.44 Favored 'General case' 0 C--O 1.24 0.559 0 CA-C-O 121.146 0.498 . . . . 0.0 110.013 -179.521 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 216' ' ' LEU . . . . . 0.665 HD21 ' HA ' ' A' ' 101' ' ' ALA . 7.3 mp -62.75 -42.62 99.76 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.146 -179.548 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 6.5 tp -63.73 -38.74 92.23 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.085 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 64.0 t0 -57.81 -46.19 85.03 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.928 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 219' ' ' GLU . . . . . 0.527 ' OE1' ' N ' ' B' ' 219' ' ' GLU . 0.3 OUTLIER -64.76 -50.72 65.73 Favored 'General case' 0 N--CA 1.462 0.163 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.37 179.631 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 220' ' ' ALA . . . . . 0.649 ' HA ' HD21 ' A' ' 97' ' ' LEU . . . -57.75 -42.79 84.66 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 120.876 0.369 . . . . 0.0 110.565 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 4.1 mm -62.07 -44.36 98.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.6 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 80.2 t80 -62.22 -44.55 96.32 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.965 0.412 . . . . 0.0 110.324 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 223' ' ' HIS . . . . . 0.552 ' CE1' ' CG ' ' A' ' 93' ' ' HIS . 13.2 t60 -56.29 -44.9 80.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.675 -179.799 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 27.2 t -75.55 -36.34 60.47 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.939 179.669 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 80.3 tt0 -56.81 -37.93 71.88 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.308 -179.399 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 9.1 t60 . . . . . 0 C--N 1.332 -0.175 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.094 -179.467 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 . . . . . 0 N--CA 1.461 0.112 0 CA-C-O 120.927 0.394 . . . . 0.0 110.599 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 88.7 p -44.09 -50.05 8.63 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 121.334 0.588 . . . . 0.0 110.066 179.216 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -63.91 -44.46 92.87 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.191 179.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.486 ' O ' HG23 ' A' ' 23' ' ' VAL . . . -57.39 -29.51 64.14 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.407 179.785 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -72.96 -50.58 22.51 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 120.885 0.374 . . . . 0.0 110.205 179.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.75 -41.98 95.5 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.912 179.731 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 72.6 tp60 -64.64 -52.94 54.73 Favored 'General case' 0 C--O 1.242 0.664 0 CA-C-O 121.255 0.55 . . . . 0.0 110.622 -179.399 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.486 HG23 ' O ' ' A' ' 19' ' ' ALA . 93.0 t -63.17 -45.94 97.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.994 -179.808 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -53.43 -43.17 67.8 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.195 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 49.2 m -59.9 -44.15 94.43 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.799 0.333 . . . . 0.0 110.47 179.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 95.6 m -63.8 -51.0 66.75 Favored 'General case' 0 C--O 1.238 0.478 0 C-N-CA 120.619 -0.432 . . . . 0.0 110.835 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.431 ' N ' ' CD1' ' A' ' 27' ' ' LEU . 7.8 mp -66.94 -19.77 65.78 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.703 179.77 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.475 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 55.8 tt0 -74.82 -59.91 2.52 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.636 179.4 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -57.12 -52.15 66.46 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.445 -179.566 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 97.0 mt -54.81 -39.75 68.81 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.226 -179.173 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.561 ' O ' ' C ' ' A' ' 32' ' ' THR . . . -40.25 -73.33 0.05 OUTLIER 'General case' 0 CA--C 1.514 -0.442 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.299 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.561 ' C ' ' O ' ' A' ' 31' ' ' ALA . 94.9 m -2.98 107.08 0.03 OUTLIER Pre-proline 0 CA--C 1.539 0.533 0 O-C-N 124.556 1.16 . . . . 0.0 111.098 -179.339 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -44.19 -50.37 7.79 Favored 'Trans proline' 0 C--N 1.308 -1.577 0 C-N-CA 122.289 1.993 . . . . 0.0 113.039 -177.378 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 10.0 t -58.39 -46.78 85.7 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.034 -179.527 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.437 ' HA ' HE22 ' A' ' 66' ' ' GLN . 50.6 ttm-85 -64.09 -43.66 94.73 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.388 -179.505 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.563 HD23 ' O ' ' A' ' 36' ' ' LEU . 2.1 tt -61.09 -52.26 65.66 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.468 -0.493 . . . . 0.0 110.545 -178.915 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 49.0 ttp -53.87 -47.0 71.48 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.737 -0.385 . . . . 0.0 110.754 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.498 HG21 ' OE1' ' A' ' 66' ' ' GLN . 88.1 mt -60.81 -47.71 92.04 Favored 'Isoleucine or valine' 0 C--O 1.239 0.534 0 CA-C-O 121.36 0.6 . . . . 0.0 110.687 -179.254 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -62.56 -41.06 98.68 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.691 179.682 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 75.4 m -59.21 -40.53 86.09 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.861 179.799 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 53.6 tp60 -61.55 -44.99 96.04 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.311 -0.404 . . . . 0.0 109.989 -179.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.443 ' O ' ' N ' ' A' ' 44' ' ' ASN . 9.7 mt -66.83 -24.29 66.14 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.971 179.634 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.432 ' C ' ' O ' ' A' ' 42' ' ' LEU . 72.1 ttp85 -33.78 -35.71 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 O-C-N 123.578 0.549 . . . . 0.0 111.063 -179.347 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.708 ' HB3' HD11 ' A' ' 47' ' ' LEU . 58.0 t-20 -62.2 -72.92 0.11 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.212 179.26 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.503 ' H ' ' CD1' ' A' ' 47' ' ' LEU . . . 153.74 -75.07 0.24 Allowed Glycine 0 CA--C 1.526 0.778 0 N-CA-C 111.206 -0.758 . . . . 0.0 111.206 179.515 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.773 ' C ' HD12 ' A' ' 47' ' ' LEU . 71.6 Cg_endo -81.19 98.53 1.03 Allowed 'Trans proline' 0 C--N 1.312 -1.377 0 C-N-CA 122.655 2.237 . . . . 0.0 112.349 179.108 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.773 HD12 ' C ' ' A' ' 46' ' ' PRO . 5.1 mp -145.61 69.4 13.62 Favored Pre-proline 0 N--CA 1.465 0.28 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.236 179.475 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_exo -45.81 163.89 0.08 OUTLIER 'Trans proline' 0 C--N 1.308 -1.575 0 C-N-CA 122.563 2.175 . . . . 0.0 112.038 179.681 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 91.5 t -54.4 -47.07 70.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 121.129 0.49 . . . . 0.0 110.373 -178.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 66.4 p -63.98 -34.81 78.83 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.454 179.301 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -67.62 -39.94 84.68 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.807 179.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 16.5 mt -62.89 -40.01 96.22 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.925 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.569 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -59.67 -48.1 83.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.982 -0.554 . . . . 0.0 109.533 179.384 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 42.6 tp10 -56.91 -46.04 82.23 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.549 -0.46 . . . . 0.0 109.991 179.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -63.38 -51.21 66.8 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 120.73 -0.388 . . . . 0.0 110.662 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 97.5 mt -81.28 -71.0 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.519 -180.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . 0.569 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 130.53 75.01 0.14 Allowed Glycine 0 N--CA 1.463 0.449 0 N-CA-C 111.206 -0.757 . . . . 0.0 111.206 179.546 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 8.8 ttp 73.87 103.07 0.07 Allowed 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 120.993 -0.283 . . . . 0.0 110.848 179.343 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 179.89 17.68 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.383 179.608 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.411 ' HG3' ' H ' ' A' ' 60' ' ' GLN . 9.2 mt-30 -51.75 -32.09 29.21 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.8 -179.349 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 50.9 m -66.8 -43.56 83.59 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.91 179.845 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.87 -30.66 71.73 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.252 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 75.1 t -72.78 -52.84 20.94 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.235 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.579 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 69.4 m -56.35 -45.33 80.48 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.416 -179.292 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 62.9 m-70 -62.87 -49.73 73.68 Favored 'General case' 0 C--O 1.239 0.501 0 CA-C-O 121.214 0.531 . . . . 0.0 111.004 179.786 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . 0.498 ' OE1' HG21 ' A' ' 38' ' ' ILE . 51.2 tt0 -62.49 -38.73 91.01 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.233 -179.742 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.5 tt -61.57 -43.34 99.04 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.646 -179.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -61.69 -42.02 98.37 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.934 -0.306 . . . . 0.0 110.616 179.77 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 89.2 t -64.48 -55.04 23.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 C-N-CA 120.135 -0.626 . . . . 0.0 110.678 -179.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 10.8 mp -61.73 -41.04 97.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.961 0.41 . . . . 0.0 110.132 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 79.0 ttt-85 -56.19 -41.72 76.01 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.094 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 8.2 t-20 -58.25 -49.89 75.51 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.6 -0.44 . . . . 0.0 110.228 -179.563 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.546 HD22 ' N ' ' A' ' 73' ' ' LEU . 4.0 mm? -68.09 -41.64 81.55 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.816 179.29 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 105.12 43.24 1.66 Allowed Glycine 0 CA--C 1.524 0.648 0 N-CA-C 111.076 -0.81 . . . . 0.0 111.076 -179.776 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.489 ' N ' HD12 ' A' ' 75' ' ' LEU . 9.0 mp -97.4 -15.22 20.77 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 110.448 -0.204 . . . . 0.0 110.448 179.378 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 30.5 m -136.83 160.22 36.95 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.344 0 CA-C-O 120.801 0.334 . . . . 0.0 110.334 -179.85 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.422 HG12 ' N ' ' A' ' 78' ' ' GLY . 51.5 t -140.16 155.48 23.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.356 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . 0.422 ' N ' HG12 ' A' ' 77' ' ' VAL . . . -126.66 149.67 17.64 Favored Glycine 0 CA--C 1.521 0.431 0 N-CA-C 110.515 -1.034 . . . . 0.0 110.515 179.612 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 16.8 t70 . . . . . 0 C--O 1.236 0.388 0 N-CA-C 110.256 -0.276 . . . . 0.0 110.256 179.952 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 77.3 t . . . . . 0 N--CA 1.469 0.505 0 CA-C-O 120.629 0.252 . . . . 0.0 110.653 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -99.51 130.02 45.72 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.198 179.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 31.3 p -146.01 165.77 28.03 Favored 'General case' 0 C--O 1.224 -0.263 0 N-CA-C 109.816 -0.439 . . . . 0.0 109.816 -179.379 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.624 ' N ' HD12 ' A' ' 89' ' ' LEU . 8.0 mp -67.53 147.5 52.72 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.369 -179.416 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 61.3 t80 -50.55 -42.38 55.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.426 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 46.8 p30 -146.71 179.68 7.4 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.508 -0.315 . . . . 0.0 110.4 -179.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . 0.595 ' O ' ' HB3' ' A' ' 95' ' ' ALA . 28.1 m -95.27 -17.65 21.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.499 -179.898 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 92.2 m-70 -40.97 -66.1 0.36 Allowed 'General case' 0 C--O 1.235 0.322 0 CA-C-O 121.368 0.604 . . . . 0.0 110.964 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 8.3 p -47.5 -34.89 3.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.347 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.595 ' HB3' ' O ' ' A' ' 92' ' ' THR . . . -64.08 -39.75 94.73 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.303 179.569 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -59.47 -45.43 91.66 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.919 -179.773 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.697 HD21 ' HA ' ' B' ' 220' ' ' ALA . 8.3 mp -60.74 -44.15 97.03 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.336 -0.546 . . . . 0.0 109.875 -179.315 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.558 HD11 HD21 ' A' ' 36' ' ' LEU . 6.1 tp -64.8 -38.33 90.62 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.526 179.521 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 63.9 t0 -57.05 -46.57 82.32 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.984 -179.487 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -70.32 -47.86 59.2 Favored 'General case' 0 C--O 1.232 0.152 0 C-N-CA 120.566 -0.454 . . . . 0.0 110.105 179.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . 0.679 ' HA ' HD21 ' B' ' 216' ' ' LEU . . . -53.46 -47.87 69.35 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.461 179.602 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 4.3 mm -63.09 -44.59 99.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 C-N-CA 120.626 -0.43 . . . . 0.0 110.64 -179.511 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 86.5 t80 -60.37 -41.42 93.68 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.018 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 64.7 t60 -69.28 -39.85 78.1 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.716 179.61 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 48.3 t -57.86 -47.82 81.59 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.544 -178.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -76.89 -54.45 6.58 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.94 0.4 . . . . 0.0 111.411 179.212 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 83.6 t60 . . . . . 0 CA--C 1.517 -0.318 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.268 -178.762 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 . . . . . 0 N--CA 1.463 0.19 0 CA-C-O 121.013 0.435 . . . . 0.0 110.591 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 83.4 p -44.51 -50.89 9.28 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.231 179.303 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -63.48 -44.01 95.65 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.235 179.861 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 138' ' ' ALA . . . . . 0.428 ' O ' HG23 ' B' ' 142' ' ' VAL . . . -57.73 -29.35 64.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.383 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -72.62 -50.33 26.02 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 121.106 0.479 . . . . 0.0 110.222 179.497 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -65.01 -40.94 95.64 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.724 179.67 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 66.1 tp60 -65.19 -53.59 42.35 Favored 'General case' 0 C--O 1.241 0.62 0 CA-C-O 121.272 0.558 . . . . 0.0 110.761 -179.298 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 142' ' ' VAL . . . . . 0.428 HG23 ' O ' ' B' ' 138' ' ' ALA . 92.6 t -62.97 -46.47 96.24 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.881 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -52.25 -43.67 64.48 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.229 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 51.0 m -59.88 -44.2 94.32 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.4 179.797 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 22.8 m -63.08 -51.76 65.37 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 120.493 -0.483 . . . . 0.0 111.065 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 146' ' ' LEU . . . . . 0.453 ' N ' ' CD1' ' B' ' 146' ' ' LEU . 7.7 mp -66.82 -19.79 65.81 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.667 179.761 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 147' ' ' GLN . . . . . 0.445 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 57.8 tt0 -74.38 -61.01 2.01 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.62 179.548 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -56.58 -51.63 67.9 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.631 -179.524 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.403 ' O ' ' C ' ' B' ' 150' ' ' ALA . 97.1 mt -55.2 -39.97 70.24 Favored 'General case' 0 CA--C 1.515 -0.386 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.307 -179.105 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 150' ' ' ALA . . . . . 0.558 ' O ' ' C ' ' B' ' 151' ' ' THR . . . -40.18 -73.94 0.04 OUTLIER 'General case' 0 CA--C 1.513 -0.464 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.262 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 151' ' ' THR . . . . . 0.558 ' C ' ' O ' ' B' ' 150' ' ' ALA . 92.4 m -2.24 106.87 0.03 OUTLIER Pre-proline 0 CA--C 1.539 0.528 0 O-C-N 124.627 1.204 . . . . 0.0 110.994 -179.333 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -43.72 -50.54 7.04 Favored 'Trans proline' 0 C--N 1.307 -1.638 0 C-N-CA 122.231 1.954 . . . . 0.0 112.977 -177.169 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 11.1 t -58.56 -46.32 87.13 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.985 -179.344 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 50.6 ttm-85 -63.68 -44.65 93.1 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 120.708 -0.397 . . . . 0.0 110.526 -179.497 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 155' ' ' LEU . . . . . 0.611 HD21 HD11 ' B' ' 217' ' ' LEU . 1.6 tt -60.88 -51.41 69.42 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.543 -0.463 . . . . 0.0 110.464 -178.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 50.4 ttp -54.07 -47.53 71.59 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.583 -0.447 . . . . 0.0 110.942 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 157' ' ' ILE . . . . . 0.491 HG21 ' OE1' ' B' ' 185' ' ' GLN . 90.5 mt -61.1 -47.51 93.24 Favored 'Isoleucine or valine' 0 C--O 1.239 0.526 0 CA-C-O 121.228 0.537 . . . . 0.0 110.58 -179.326 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -62.51 -41.16 98.66 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.654 179.467 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 159' ' ' THR . . . . . 0.435 ' OG1' ' CD2' ' B' ' 155' ' ' LEU . 18.6 m -59.37 -40.11 85.43 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.813 179.718 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 56.4 tp60 -61.6 -45.23 94.98 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.061 0.458 . . . . 0.0 109.921 -179.71 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 161' ' ' LEU . . . . . 0.438 ' O ' ' N ' ' B' ' 163' ' ' ASN . 9.5 mt -66.39 -23.84 66.39 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.96 179.702 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 162' ' ' ARG . . . . . 0.436 ' C ' ' O ' ' B' ' 161' ' ' LEU . 72.1 ttp85 -34.05 -35.54 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 O-C-N 123.533 0.521 . . . . 0.0 111.114 -179.214 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 163' ' ' ASN . . . . . 0.676 ' HB3' HD11 ' B' ' 166' ' ' LEU . 58.8 t-20 -61.77 -71.41 0.15 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.26 179.382 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 164' ' ' GLY . . . . . 0.479 ' H ' ' CD1' ' B' ' 166' ' ' LEU . . . 153.36 -76.33 0.22 Allowed Glycine 0 CA--C 1.527 0.822 0 N-CA-C 111.157 -0.777 . . . . 0.0 111.157 179.545 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 165' ' ' PRO . . . . . 0.792 ' C ' HD12 ' B' ' 166' ' ' LEU . 74.3 Cg_endo -82.08 101.74 1.16 Allowed 'Trans proline' 0 N--CA 1.492 1.391 0 C-N-CA 122.605 2.203 . . . . 0.0 112.182 179.174 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 166' ' ' LEU . . . . . 0.792 HD12 ' C ' ' B' ' 165' ' ' PRO . 5.3 mp -146.61 69.76 12.44 Favored Pre-proline 0 N--CA 1.464 0.246 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.397 179.666 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_exo -45.57 163.09 0.09 OUTLIER 'Trans proline' 0 C--N 1.307 -1.614 0 C-N-CA 122.52 2.147 . . . . 0.0 112.049 179.431 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . 87.6 t -53.85 -46.79 64.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 121.099 0.476 . . . . 0.0 110.402 -179.195 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 169' ' ' THR . . . . . . . . . . . . . 64.2 p -63.94 -35.46 80.74 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.472 179.374 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -66.79 -40.14 88.02 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.095 179.621 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 16.5 mt -63.12 -40.55 97.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.137 179.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 172' ' ' ALA . . . . . 0.577 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -59.06 -47.86 83.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.487 179.48 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 42.3 tp10 -57.02 -45.93 82.74 Favored 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 120.46 -0.496 . . . . 0.0 110.029 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -63.31 -49.72 72.89 Favored 'General case' 0 C--O 1.231 0.103 0 C-N-CA 120.669 -0.412 . . . . 0.0 110.717 -179.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 96.3 mt -82.62 -71.16 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.432 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 176' ' ' GLY . . . . . 0.577 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 129.8 74.25 0.14 Allowed Glycine 0 N--CA 1.463 0.476 0 N-CA-C 111.205 -0.758 . . . . 0.0 111.205 179.419 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 177' ' ' MET . . . . . 0.421 ' CB ' ' O ' ' B' ' 176' ' ' GLY . 3.4 tmm? 75.43 102.08 0.07 Allowed 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 120.668 -0.413 . . . . 0.0 110.879 179.407 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 179.26 18.08 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.335 179.679 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 12.1 mt-30 -52.5 -32.01 38.1 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.651 -179.299 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 47.0 m -66.4 -43.44 85.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.921 0.391 . . . . 0.0 110.903 179.72 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -63.92 -30.77 71.83 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.365 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 94.5 t -72.78 -52.86 20.83 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.244 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.777 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 74.3 m -56.49 -45.49 80.95 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.456 -179.48 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 58.6 m-70 -62.22 -48.91 77.89 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.111 0.481 . . . . 0.0 110.661 179.789 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 185' ' ' GLN . . . . . 0.491 ' OE1' HG21 ' B' ' 157' ' ' ILE . 50.6 tt0 -62.9 -39.72 95.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.262 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 5.4 tt -61.05 -43.31 99.07 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.559 -179.722 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -61.81 -42.36 98.92 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 120.979 -0.288 . . . . 0.0 110.687 179.712 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 99.4 t -64.18 -54.89 25.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 C-N-CA 120.158 -0.617 . . . . 0.0 110.691 -179.663 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 10.6 mp -61.75 -41.08 97.2 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.81 0.338 . . . . 0.0 110.164 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 79.5 ttt-85 -54.91 -42.52 72.3 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.156 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -57.82 -50.48 73.13 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.504 -0.478 . . . . 0.0 110.335 -179.683 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 192' ' ' LEU . . . . . 0.534 ' N ' HD22 ' B' ' 192' ' ' LEU . 3.9 mm? -66.76 -42.91 85.4 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.851 0.358 . . . . 0.0 110.853 179.496 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 105.77 42.14 1.74 Allowed Glycine 0 CA--C 1.525 0.717 0 N-CA-C 111.154 -0.778 . . . . 0.0 111.154 -179.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 194' ' ' LEU . . . . . 0.487 ' N ' HD12 ' B' ' 194' ' ' LEU . 8.1 mp -96.46 -15.1 21.92 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 120.496 0.189 . . . . 0.0 110.682 179.643 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 29.4 m -138.27 161.92 30.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.773 0.321 . . . . 0.0 110.269 -179.771 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 196' ' ' VAL . . . . . 0.461 HG12 ' N ' ' B' ' 197' ' ' GLY . 61.9 t -141.87 157.99 20.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.535 179.42 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 197' ' ' GLY . . . . . 0.461 ' N ' HG12 ' B' ' 196' ' ' VAL . . . -129.53 149.38 18.66 Favored Glycine 0 CA--C 1.521 0.447 0 N-CA-C 110.625 -0.99 . . . . 0.0 110.625 179.437 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 17.8 t70 . . . . . 0 C--O 1.237 0.428 0 CA-C-O 120.863 0.363 . . . . 0.0 110.709 -179.711 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 70.7 t . . . . . 0 N--CA 1.463 0.178 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 77.0 m-85 -102.59 132.7 48.51 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.468 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 36.1 p -150.07 169.26 21.65 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.029 -179.413 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 208' ' ' LEU . . . . . 0.619 ' N ' HD12 ' B' ' 208' ' ' LEU . 7.8 mp -68.78 149.18 49.29 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.566 -179.28 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 59.3 t80 -53.46 -43.81 68.42 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.547 179.709 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 40.7 p30 -144.47 179.9 6.97 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.42 -179.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 211' ' ' THR . . . . . 0.59 ' O ' ' HB3' ' B' ' 214' ' ' ALA . 25.4 m -96.16 -17.8 20.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.596 -179.92 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 212' ' ' HIS . . . . . . . . . . . . . 89.4 m-70 -40.77 -65.82 0.38 Allowed 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 121.38 0.61 . . . . 0.0 110.706 179.674 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 7.5 p -47.57 -34.45 3.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.345 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 214' ' ' ALA . . . . . 0.59 ' HB3' ' O ' ' B' ' 211' ' ' THR . . . -65.45 -38.25 89.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.08 179.491 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -60.89 -45.57 94.1 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.032 -179.772 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 216' ' ' LEU . . . . . 0.679 HD21 ' HA ' ' A' ' 101' ' ' ALA . 8.2 mp -61.09 -43.72 98.45 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.445 -0.502 . . . . 0.0 109.712 -179.579 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 217' ' ' LEU . . . . . 0.611 HD11 HD21 ' B' ' 155' ' ' LEU . 7.1 tp -64.47 -40.21 95.27 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.461 179.309 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 65.7 t0 -56.44 -46.31 80.35 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.028 -179.49 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 219' ' ' GLU . . . . . . . . . . . . . 16.7 tp10 -70.13 -48.94 55.36 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.146 179.724 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 220' ' ' ALA . . . . . 0.697 ' HA ' HD21 ' A' ' 97' ' ' LEU . . . -53.22 -47.53 68.89 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.331 179.584 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 4.5 mm -62.99 -44.6 99.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.597 -179.71 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 90.0 t80 -60.02 -42.82 95.18 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.985 -179.794 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 223' ' ' HIS . . . . . . . . . . . . . 47.8 t60 -68.41 -38.69 81.48 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.619 179.247 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 11.5 t -57.41 -48.78 78.19 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.648 -178.827 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -77.14 -53.19 8.07 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.958 0.408 . . . . 0.0 111.428 179.111 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 86.2 t60 . . . . . 0 CA--C 1.518 -0.261 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.274 -178.794 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 . . . . . 0 N--CA 1.464 0.27 0 CA-C-O 120.781 0.324 . . . . 0.0 110.645 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 11.4 t -56.43 -48.16 77.55 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-O 121.362 0.601 . . . . 0.0 109.723 179.338 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 90.7 mm-40 -65.3 -47.48 76.45 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.02 179.42 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.712 ' O ' HG23 ' A' ' 23' ' ' VAL . . . -56.31 -29.12 60.82 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.237 -179.896 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -71.28 -49.71 40.2 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 120.867 -0.333 . . . . 0.0 110.152 179.554 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.25 -44.01 95.62 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.525 179.908 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -59.4 -49.36 78.09 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-O 121.162 0.506 . . . . 0.0 110.352 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.712 HG23 ' O ' ' A' ' 19' ' ' ALA . 84.4 t -61.71 -44.26 98.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.025 179.626 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.505 ' HB1' ' N ' ' B' ' 151' ' ' THR . . . -57.78 -41.9 82.99 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 120.876 0.37 . . . . 0.0 110.032 179.868 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 48.3 t -58.76 -44.84 90.69 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.021 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.453 ' OG1' ' O ' ' A' ' 23' ' ' VAL . 71.3 p -64.42 -47.28 79.73 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 120.989 0.423 . . . . 0.0 110.566 179.362 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 95.1 mt -63.95 -23.77 67.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.406 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.494 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 54.9 tt0 -75.65 -56.49 4.64 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.733 179.542 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.65 -55.1 39.38 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.786 -179.333 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.478 ' O ' ' O ' ' A' ' 31' ' ' ALA . 3.8 mm? -46.8 -35.14 5.92 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 -179.18 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.494 ' HB3' ' O ' ' A' ' 28' ' ' GLN . . . -55.07 -161.92 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.064 -0.517 . . . . 0.0 109.858 179.428 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.549 ' CB ' HH11 ' A' ' 35' ' ' ARG . 1.0 OUTLIER 81.86 114.41 0.03 OUTLIER Pre-proline 0 C--N 1.323 -0.544 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.182 179.827 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -49.19 -42.6 39.34 Favored 'Trans proline' 0 N--CA 1.496 1.641 0 C-N-CA 122.265 1.977 . . . . 0.0 112.957 -179.14 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 47.4 t -59.36 -45.54 91.11 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.881 -179.191 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.549 HH11 ' CB ' ' A' ' 32' ' ' THR . 84.6 mtt85 -62.03 -44.31 96.98 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.738 -0.385 . . . . 0.0 111.186 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -61.3 -47.59 85.27 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.476 -0.49 . . . . 0.0 110.96 -179.52 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.435 ' O ' ' OE1' ' A' ' 41' ' ' GLN . 20.2 ttm -56.54 -48.95 76.19 Favored 'General case' 0 C--N 1.319 -0.743 0 C-N-CA 120.285 -0.566 . . . . 0.0 110.301 -179.804 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 37.8 mm -63.5 -43.66 98.45 Favored 'Isoleucine or valine' 0 C--O 1.234 0.256 0 CA-C-O 121.045 0.45 . . . . 0.0 110.44 -179.752 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 mt -62.15 -39.75 93.66 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.456 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 18.0 m -60.55 -43.72 96.9 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.101 -0.5 . . . . 0.0 109.981 179.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.435 ' OE1' ' O ' ' A' ' 37' ' ' MET . 3.4 mp0 -61.31 -44.9 96.44 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.985 0.422 . . . . 0.0 110.041 179.809 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 97.9 mt -61.79 -40.23 94.47 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.066 -179.434 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.536 ' NH2' ' OD2' ' A' ' 99' ' ' ASP . 20.3 tpt180 -63.72 -37.67 88.21 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.951 179.974 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -56.95 -42.33 79.91 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.692 -178.54 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 169.38 -174.49 43.77 Favored Glycine 0 CA--C 1.527 0.786 0 N-CA-C 111.007 -0.837 . . . . 0.0 111.007 179.724 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -77.83 122.34 5.83 Favored 'Trans proline' 0 C--N 1.311 -1.408 0 C-N-CA 122.819 2.346 . . . . 0.0 111.663 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.441 ' H ' HD12 ' A' ' 47' ' ' LEU . 0.2 OUTLIER -150.16 95.89 3.55 Favored Pre-proline 0 CA--C 1.537 0.451 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.961 -179.248 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_exo -47.06 173.22 0.03 OUTLIER 'Trans proline' 0 C--N 1.306 -1.664 0 C-N-CA 122.495 2.13 . . . . 0.0 112.284 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 73.0 t -54.64 -45.02 72.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.433 -179.23 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 15.3 m -59.78 -40.24 87.62 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.22 0.533 . . . . 0.0 110.255 179.208 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 56.3 t0 -65.71 -38.98 90.68 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.16 179.517 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.6 ' O ' HD13 ' A' ' 52' ' ' LEU . 0.3 OUTLIER -62.46 -44.19 97.0 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-O 121.308 0.575 . . . . 0.0 110.028 -179.565 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.497 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -55.87 -48.44 75.57 Favored 'General case' 0 N--CA 1.444 -0.738 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 179.707 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 44.9 tp10 -56.48 -48.43 77.14 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.318 -0.553 . . . . 0.0 110.549 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -54.29 -58.07 8.8 Favored 'General case' 0 C--N 1.332 -0.163 0 C-N-CA 120.896 -0.322 . . . . 0.0 110.614 -179.467 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 90.6 mt -86.35 -73.16 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.417 179.775 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . 0.497 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 131.88 98.09 0.72 Allowed Glycine 0 N--CA 1.461 0.316 0 N-CA-C 111.055 -0.818 . . . . 0.0 111.055 -179.679 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 64.3 mtt 66.48 99.54 0.05 OUTLIER 'General case' 0 C--N 1.34 0.18 0 CA-C-O 120.767 0.317 . . . . 0.0 110.722 178.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.41 ' H ' ' H ' ' A' ' 60' ' ' GLN . 2.1 mt-10 -179.53 15.12 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.359 179.864 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.41 ' H ' ' H ' ' A' ' 59' ' ' GLU . 52.0 mt-30 -55.54 -36.9 67.29 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.549 -179.372 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 78.1 p -62.09 -49.29 76.53 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.821 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.34 -35.87 72.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.278 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 75.8 t -67.19 -52.95 37.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.596 -179.694 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 10.4 t -56.84 -42.29 79.38 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.248 -179.416 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -63.17 -49.8 72.88 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.816 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 86.6 mm-40 -63.72 -41.17 98.12 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.594 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.8 tp -62.52 -44.66 95.82 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.359 -179.679 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 70.4 mmt-85 -62.43 -42.42 99.44 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.848 0.356 . . . . 0.0 110.66 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 71.9 t -67.23 -54.37 24.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 C-N-CA 120.262 -0.575 . . . . 0.0 110.468 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 92.4 mt -58.49 -41.4 85.24 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.063 -179.323 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 73.5 ttt180 -58.55 -41.67 86.14 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.405 179.729 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 93.3 m-20 -57.65 -50.39 73.32 Favored 'General case' 0 C--N 1.332 -0.171 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.455 -179.421 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.8 mt -67.7 -40.76 84.3 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.934 0.397 . . . . 0.0 110.407 -179.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 103.09 78.76 1.31 Allowed Glycine 0 CA--C 1.52 0.398 0 N-CA-C 110.872 -0.891 . . . . 0.0 110.872 -179.644 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.424 HD11 HG21 ' A' ' 94' ' ' VAL . 6.7 tp -144.9 -9.35 0.61 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.943 0.401 . . . . 0.0 110.793 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 33.8 m -139.05 158.34 29.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.454 -179.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.476 HG12 ' N ' ' A' ' 78' ' ' GLY . 48.4 t -143.99 157.69 15.87 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.577 -179.793 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . 0.476 ' N ' HG12 ' A' ' 77' ' ' VAL . . . -134.44 144.48 16.45 Favored Glycine 0 CA--C 1.521 0.463 0 N-CA-C 110.388 -1.085 . . . . 0.0 110.388 179.623 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 46.9 t0 . . . . . 0 C--O 1.234 0.243 0 CA-C-O 120.919 0.39 . . . . 0.0 110.343 179.519 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 46.6 t . . . . . 0 C--O 1.224 -0.278 0 CA-C-O 120.752 0.31 . . . . 0.0 110.218 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -106.88 131.47 53.93 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.288 179.749 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.435 ' O ' ' O ' ' A' ' 77' ' ' VAL . 99.9 p -150.09 166.88 28.42 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.487 ' O ' ' N ' ' A' ' 91' ' ' ASP . 0.3 OUTLIER -78.9 154.16 29.93 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.175 -179.361 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.402 ' CE2' ' OG1' ' A' ' 92' ' ' THR . 71.0 t80 -46.17 -15.55 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.434 179.688 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.487 ' N ' ' O ' ' A' ' 89' ' ' LEU . 52.8 t0 41.94 89.81 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.189 179.055 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . 0.459 ' OG1' ' O ' ' A' ' 91' ' ' ASP . 2.1 m -169.58 -133.8 0.02 OUTLIER 'General case' 0 C--O 1.236 0.353 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.56 179.656 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . 0.444 ' H ' HG22 ' A' ' 92' ' ' THR . 40.4 m80 -55.08 -53.06 60.65 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.021 -179.89 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.424 HG21 HD11 ' A' ' 75' ' ' LEU . 95.3 t -49.78 -39.53 14.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.245 179.754 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.52 -41.44 98.86 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.485 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 58.6 tt0 -60.65 -46.34 90.71 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.006 0.432 . . . . 0.0 110.11 -179.865 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.463 HD11 ' N ' ' B' ' 220' ' ' ALA . 3.7 mm? -62.32 -43.14 99.52 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.433 179.677 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.504 ' O ' HG22 ' A' ' 102' ' ' ILE . 62.3 tp -65.06 -39.29 93.07 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.422 179.869 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . 0.536 ' OD2' ' NH2' ' A' ' 43' ' ' ARG . 94.2 m-20 -62.71 -39.84 95.27 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.154 0.502 . . . . 0.0 110.839 -178.983 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.464 ' OE2' ' OE2' ' B' ' 219' ' ' GLU . 97.5 mt-10 -74.16 -52.62 11.93 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.825 179.67 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . 0.447 ' N ' HD11 ' B' ' 216' ' ' LEU . . . -57.89 -48.37 80.06 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.965 -179.629 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.561 HG23 ' N ' ' A' ' 103' ' ' TYR . 10.4 tp -64.73 -46.1 93.2 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 CA-C-O 120.892 0.377 . . . . 0.0 111.111 -179.096 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' TYR . . . . . 0.561 ' N ' HG23 ' A' ' 102' ' ' ILE . 91.0 t80 -62.98 -43.97 97.31 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.783 -179.422 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 3.4 m-70 -67.31 -41.44 85.32 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.756 -179.734 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 6.4 t -67.93 -44.29 77.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.977 0.417 . . . . 0.0 110.744 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 15.1 tm-20 -67.63 -29.2 68.46 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.569 -179.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 18.7 t60 . . . . . 0 N--CA 1.454 -0.26 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.262 -178.946 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 . . . . . 0 N--CA 1.464 0.255 0 CA-C-O 120.833 0.349 . . . . 0.0 110.639 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 9.9 t -55.15 -48.68 73.38 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.236 0.541 . . . . 0.0 109.788 179.514 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 95.6 mm-40 -65.36 -47.6 75.88 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.937 179.535 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 138' ' ' ALA . . . . . 0.609 ' O ' HG23 ' B' ' 142' ' ' VAL . . . -56.02 -29.81 60.93 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.196 -179.837 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -71.28 -49.88 38.34 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 120.888 0.375 . . . . 0.0 110.156 179.653 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -61.1 -41.14 96.12 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.529 179.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -61.21 -49.86 75.45 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-O 121.214 0.531 . . . . 0.0 110.427 179.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 142' ' ' VAL . . . . . 0.609 HG23 ' O ' ' B' ' 138' ' ' ALA . 93.5 t -61.78 -44.46 98.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.145 179.697 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 143' ' ' ALA . . . . . 0.477 ' HB1' ' N ' ' A' ' 32' ' ' THR . . . -57.01 -42.19 79.88 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 120.804 0.335 . . . . 0.0 110.167 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 14.0 t -58.71 -44.97 90.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.98 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 77.5 p -64.2 -46.36 84.27 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 120.967 0.413 . . . . 0.0 110.451 179.466 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 95.4 mt -64.51 -23.4 67.26 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.435 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 147' ' ' GLN . . . . . 0.484 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 57.1 tt0 -75.64 -56.36 4.76 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.785 179.527 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -59.12 -55.2 38.03 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.766 -179.393 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.467 ' O ' ' O ' ' B' ' 150' ' ' ALA . 3.8 mm? -46.66 -36.38 6.99 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 -179.127 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 150' ' ' ALA . . . . . 0.484 ' HB3' ' O ' ' B' ' 147' ' ' GLN . . . -54.86 -162.2 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.927 179.602 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 151' ' ' THR . . . . . 0.562 ' CB ' HH11 ' B' ' 154' ' ' ARG . 0.6 OUTLIER 82.79 115.07 0.03 OUTLIER Pre-proline 0 CA--C 1.54 0.564 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.294 179.694 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -48.98 -42.68 37.74 Favored 'Trans proline' 0 N--CA 1.496 1.618 0 C-N-CA 122.18 1.92 . . . . 0.0 113.063 -179.303 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 39.6 t -60.16 -45.97 91.28 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.976 -179.131 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 154' ' ' ARG . . . . . 0.562 HH11 ' CB ' ' B' ' 151' ' ' THR . 84.4 mtt85 -62.56 -43.6 98.41 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.125 -179.722 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 155' ' ' LEU . . . . . 0.415 HD13 ' HA ' ' B' ' 155' ' ' LEU . 4.2 mm? -62.69 -47.0 85.52 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.72 -0.392 . . . . 0.0 111.036 -179.479 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 36.4 ttp -58.34 -48.92 79.01 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.266 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 35.3 mm -63.28 -43.84 98.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 121.054 0.454 . . . . 0.0 110.371 179.76 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 36.9 mt -61.5 -40.68 95.48 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.222 -179.709 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 19.9 m -59.97 -45.14 93.66 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.005 179.694 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -58.03 -45.1 87.5 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.676 -0.41 . . . . 0.0 109.991 179.864 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 161' ' ' LEU . . . . . . . . . . . . . 97.0 mt -62.03 -40.07 94.47 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.122 0.486 . . . . 0.0 109.996 -179.47 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 162' ' ' ARG . . . . . 0.548 ' NH2' ' OD2' ' B' ' 218' ' ' ASP . 21.5 tpt180 -63.52 -37.99 89.41 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.951 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 98.4 m-20 -56.57 -42.09 78.04 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.588 -178.64 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . 169.43 -175.91 43.56 Favored Glycine 0 CA--C 1.528 0.876 0 N-CA-C 110.997 -0.841 . . . . 0.0 110.997 179.665 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -76.99 123.26 6.66 Favored 'Trans proline' 0 N--CA 1.492 1.413 0 C-N-CA 122.856 2.371 . . . . 0.0 111.593 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 166' ' ' LEU . . . . . 0.449 ' H ' HD12 ' B' ' 166' ' ' LEU . 0.2 OUTLIER -150.61 96.38 3.39 Favored Pre-proline 0 CA--C 1.538 0.504 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.016 -179.238 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_exo -47.06 173.31 0.03 OUTLIER 'Trans proline' 0 C--N 1.306 -1.71 0 C-N-CA 122.456 2.104 . . . . 0.0 112.309 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . 81.7 t -54.77 -45.2 73.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.43 -179.292 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 169' ' ' THR . . . . . . . . . . . . . 15.7 m -59.99 -40.28 88.61 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.186 0.517 . . . . 0.0 110.229 179.199 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -65.45 -38.64 90.45 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.191 179.297 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 171' ' ' LEU . . . . . 0.597 ' O ' HD13 ' B' ' 171' ' ' LEU . 0.3 OUTLIER -62.63 -44.82 95.33 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.272 0.558 . . . . 0.0 110.011 -179.587 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 172' ' ' ALA . . . . . 0.486 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -55.66 -48.07 75.64 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 179.782 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 43.6 tp10 -56.04 -48.39 76.07 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.308 -0.557 . . . . 0.0 110.502 179.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -54.82 -58.35 7.93 Favored 'General case' 0 C--N 1.333 -0.136 0 C-N-CA 120.749 -0.38 . . . . 0.0 110.776 -179.511 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 87.7 mt -86.62 -72.98 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.454 179.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 176' ' ' GLY . . . . . 0.486 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 130.54 99.41 0.84 Allowed Glycine 0 N--CA 1.461 0.323 0 N-CA-C 111.119 -0.792 . . . . 0.0 111.119 -179.779 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 62.5 mtt 66.27 95.71 0.06 Allowed 'General case' 0 CA--C 1.521 -0.172 0 CA-C-O 120.887 0.375 . . . . 0.0 110.745 178.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -176.71 14.65 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.404 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 54.8 mt-30 -55.79 -37.07 68.11 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.64 -179.247 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 64.3 p -61.49 -48.43 81.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.036 -179.726 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -59.2 -35.4 73.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.233 -179.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 97.5 t -67.12 -52.91 38.38 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.101 0 C-N-CA 120.467 -0.493 . . . . 0.0 110.726 -179.713 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 10.7 t -57.11 -42.18 80.33 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.289 -179.576 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 86.0 t60 -63.42 -50.27 70.48 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.905 -179.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 90.6 mm-40 -63.69 -40.48 96.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.949 0.404 . . . . 0.0 110.668 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 8.6 tp -62.52 -44.94 95.13 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.403 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 73.1 mmt-85 -62.46 -42.31 99.38 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.746 -179.761 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 77.7 t -66.34 -54.58 24.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 C-N-CA 120.179 -0.608 . . . . 0.0 110.506 -179.741 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 87.2 mt -58.83 -41.15 86.19 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 -179.251 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 71.8 ttt180 -57.95 -41.37 82.69 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.272 179.704 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 -59.82 -49.87 76.03 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 120.488 -0.485 . . . . 0.0 110.447 -179.33 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 192' ' ' LEU . . . . . 0.4 ' N ' HD23 ' B' ' 192' ' ' LEU . 9.2 mt -67.55 -39.41 84.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.816 0.341 . . . . 0.0 110.464 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 101.28 80.98 1.54 Allowed Glycine 0 N--CA 1.462 0.42 0 N-CA-C 110.727 -0.949 . . . . 0.0 110.727 -179.639 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 194' ' ' LEU . . . . . 0.419 HD21 HD11 ' B' ' 149' ' ' LEU . 4.9 tp -147.47 -9.68 0.42 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.777 0.322 . . . . 0.0 110.768 -179.932 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 26.7 m -140.05 159.18 26.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.412 -179.636 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 196' ' ' VAL . . . . . 0.515 HG12 ' N ' ' B' ' 197' ' ' GLY . 47.7 t -145.62 159.62 12.46 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.493 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 197' ' ' GLY . . . . . 0.515 ' N ' HG12 ' B' ' 196' ' ' VAL . . . -135.68 145.21 17.22 Favored Glycine 0 CA--C 1.523 0.563 0 N-CA-C 110.409 -1.077 . . . . 0.0 110.409 179.615 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 67.3 t0 . . . . . 0 C--O 1.234 0.27 0 CA-C-O 120.868 0.366 . . . . 0.0 110.337 179.564 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 47.2 t . . . . . 0 N--CA 1.465 0.304 0 CA-C-O 120.785 0.326 . . . . 0.0 110.179 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 96.3 m-85 -106.07 131.97 52.7 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.417 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 207' ' ' SER . . . . . 0.443 ' O ' ' O ' ' B' ' 196' ' ' VAL . 40.6 p -150.52 167.26 27.72 Favored 'General case' 0 CA--C 1.52 -0.196 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 208' ' ' LEU . . . . . 0.475 ' O ' HD12 ' B' ' 208' ' ' LEU . 0.3 OUTLIER -78.97 154.12 29.81 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.224 -179.158 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 66.4 t80 -46.36 -15.85 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.805 0.336 . . . . 0.0 110.529 179.647 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 210' ' ' ASP . . . . . 0.473 ' N ' ' O ' ' B' ' 208' ' ' LEU . 35.5 t0 42.45 89.72 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.21 179.107 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 211' ' ' THR . . . . . 0.489 HG22 ' H ' ' B' ' 212' ' ' HIS . 2.3 m -169.32 -134.77 0.02 OUTLIER 'General case' 0 C--O 1.238 0.47 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.471 179.634 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 212' ' ' HIS . . . . . 0.489 ' H ' HG22 ' B' ' 211' ' ' THR . 40.4 m80 -55.36 -53.51 55.3 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.02 -179.904 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 92.9 t -48.9 -38.88 11.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.214 179.741 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 214' ' ' ALA . . . . . . . . . . . . . . . -63.26 -42.24 99.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.347 179.831 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 58.8 tt0 -58.78 -46.62 87.1 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.073 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 216' ' ' LEU . . . . . 0.457 ' CD2' ' N ' ' B' ' 216' ' ' LEU . 3.5 mm? -61.99 -42.69 99.42 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.441 179.647 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 217' ' ' LEU . . . . . 0.476 ' O ' HG22 ' B' ' 221' ' ' ILE . 58.1 tp -65.4 -39.97 92.83 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.509 179.75 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 218' ' ' ASP . . . . . 0.548 ' OD2' ' NH2' ' B' ' 162' ' ' ARG . 98.8 m-20 -62.46 -40.16 95.74 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.163 0.506 . . . . 0.0 110.975 -178.941 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 219' ' ' GLU . . . . . 0.464 ' OE2' ' OE2' ' A' ' 100' ' ' GLU . 97.0 mt-10 -74.36 -53.45 9.62 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.807 179.564 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 220' ' ' ALA . . . . . 0.463 ' N ' HD11 ' A' ' 97' ' ' LEU . . . -56.8 -48.75 77.25 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.852 -179.305 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 221' ' ' ILE . . . . . 0.54 HG23 ' N ' ' B' ' 222' ' ' TYR . 3.8 tp -64.94 -45.76 93.77 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 C-N-CA 120.571 -0.452 . . . . 0.0 111.11 -179.174 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 222' ' ' TYR . . . . . 0.54 ' N ' HG23 ' B' ' 221' ' ' ILE . 90.4 t80 -62.36 -43.75 98.09 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.547 -179.46 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 223' ' ' HIS . . . . . . . . . . . . . 2.9 m-70 -67.47 -41.45 84.58 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.7 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 6.2 t -68.02 -44.5 76.37 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.915 0.388 . . . . 0.0 110.834 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 15.3 tm-20 -67.81 -28.78 67.87 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.664 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 15.7 t60 . . . . . 0 N--CA 1.454 -0.253 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.263 -178.987 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . 0.448 ' OD1' ' N ' ' A' ' 16' ' ' ASP . 22.8 p-10 . . . . . 0 N--CA 1.464 0.254 0 CA-C-O 120.948 0.404 . . . . 0.0 110.673 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 78.3 p -54.74 -49.69 70.19 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.299 178.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 11.1 tp-100 -62.44 -45.1 94.59 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.308 -0.405 . . . . 0.0 109.909 179.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.557 ' O ' HG23 ' A' ' 23' ' ' VAL . . . -57.14 -29.41 63.56 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.377 179.914 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -72.72 -51.73 18.04 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 121.201 0.524 . . . . 0.0 110.416 179.547 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.2 -41.08 97.23 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.954 179.76 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 59.4 tt0 -64.92 -53.3 48.68 Favored 'General case' 0 C--O 1.241 0.654 0 CA-C-O 121.279 0.561 . . . . 0.0 110.902 -179.412 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.557 HG23 ' O ' ' A' ' 19' ' ' ALA . 96.6 t -61.56 -44.29 98.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.183 179.633 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -54.71 -42.53 71.61 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 179.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.6 t -58.81 -44.77 90.89 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 179.736 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 12.0 m -63.3 -45.73 90.0 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.26 179.024 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 95.7 mt -64.85 -22.28 66.96 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.523 179.717 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.524 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 58.1 tt0 -74.77 -55.66 5.6 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.425 179.49 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.66 -55.58 33.31 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.375 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.509 ' O ' ' O ' ' A' ' 31' ' ' ALA . 89.9 mt -44.94 -34.64 2.49 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.312 -179.565 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.524 ' HB3' ' O ' ' A' ' 28' ' ' GLN . . . -56.41 -139.97 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 O-C-N 123.517 0.511 . . . . 0.0 110.568 179.152 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.456 ' O ' ' O ' ' A' ' 31' ' ' ALA . 85.4 m 57.23 115.3 0.02 OUTLIER Pre-proline 0 C--N 1.323 -0.575 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.547 179.784 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -49.55 -46.76 25.41 Favored 'Trans proline' 0 N--CA 1.493 1.465 0 C-N-CA 122.371 2.047 . . . . 0.0 112.722 -179.337 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 57.9 m -62.87 -46.82 86.05 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.307 -178.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.2 tpp180 -63.01 -47.62 82.3 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.448 -178.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.584 HD23 ' O ' ' A' ' 36' ' ' LEU . 3.2 tt -60.38 -53.27 59.56 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.439 -178.636 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 62.1 ttp -50.77 -48.3 59.37 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-O 120.909 0.385 . . . . 0.0 110.167 179.776 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 5.5 mm -62.26 -43.83 98.44 Favored 'Isoleucine or valine' 0 C--O 1.239 0.519 0 CA-C-O 121.091 0.472 . . . . 0.0 110.525 179.501 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 14.3 mt -61.79 -41.11 97.32 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.288 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 9.8 m -58.36 -40.44 82.26 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.01 -0.541 . . . . 0.0 109.672 179.539 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.588 HE22 HD11 ' A' ' 56' ' ' ILE . 51.6 mt-30 -61.85 -44.28 97.15 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.469 179.499 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.517 ' O ' ' N ' ' A' ' 44' ' ' ASN . 80.5 mt -63.46 -31.57 72.76 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.127 179.472 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.548 HH21 ' CG ' ' A' ' 99' ' ' ASP . 33.4 tpt85 -33.9 -32.5 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 O-C-N 123.534 0.521 . . . . 0.0 110.866 -179.593 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.517 ' N ' ' O ' ' A' ' 42' ' ' LEU . 81.2 m-20 -72.44 -84.22 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.43 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 149.73 -76.37 0.24 Allowed Glycine 0 CA--C 1.527 0.82 0 N-CA-C 110.882 -0.887 . . . . 0.0 110.882 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -68.71 84.25 0.51 Allowed 'Trans proline' 0 C--N 1.307 -1.652 0 C-N-CA 122.742 2.294 . . . . 0.0 112.328 -179.379 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -156.9 68.07 4.33 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-O 121.045 0.45 . . . . 0.0 110.108 -179.747 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_exo -45.07 170.52 0.02 OUTLIER 'Trans proline' 0 C--N 1.298 -2.107 0 C-N-CA 122.416 2.078 . . . . 0.0 112.168 -179.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 80.8 t -54.32 -45.44 68.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.335 -179.593 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 15.1 m -61.34 -39.23 89.8 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.16 0.505 . . . . 0.0 110.292 179.117 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -66.31 -41.29 89.9 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.106 179.686 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.616 ' O ' HD13 ' A' ' 52' ' ' LEU . 0.2 OUTLIER -61.77 -42.58 99.17 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.775 -179.764 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.577 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -56.37 -47.78 78.19 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 179.323 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -54.64 -45.27 73.75 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.686 -0.406 . . . . 0.0 109.939 179.639 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -55.52 -57.59 11.27 Favored 'General case' 0 C--N 1.333 -0.139 0 C-N-CA 120.763 -0.375 . . . . 0.0 110.649 179.687 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.588 HD11 HE22 ' A' ' 41' ' ' GLN . 95.3 mt -80.48 -69.11 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.389 179.36 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . 0.577 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 131.95 75.93 0.12 Allowed Glycine 0 CA--C 1.521 0.438 0 N-CA-C 110.931 -0.868 . . . . 0.0 110.931 179.817 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.438 ' CB ' ' O ' ' A' ' 57' ' ' GLY . 1.1 tmm? 77.72 95.91 0.06 Allowed 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.708 179.581 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 19.9 tp10 -174.06 34.25 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.18 179.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -69.63 -20.91 63.59 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.957 -179.291 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 77.9 p -69.17 -43.55 74.03 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.958 -179.679 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.25 -35.79 81.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.266 179.764 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 87.0 t -66.97 -51.84 50.35 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.232 0 C-N-CA 120.727 -0.389 . . . . 0.0 110.433 -179.729 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 51.7 m -55.24 -44.04 75.14 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.53 -0.468 . . . . 0.0 110.358 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' HIS . . . . . 0.408 ' O ' HG22 ' A' ' 69' ' ' VAL . 76.1 m-70 -68.42 -44.1 75.73 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.033 179.733 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 64.9 mt-30 -60.77 -40.62 93.18 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.381 -179.693 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -68.06 -39.85 82.88 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 120.975 0.417 . . . . 0.0 110.561 179.141 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.548 ' NH1' HD21 ' A' ' 72' ' ' ASN . 17.5 tpt85 -58.81 -47.19 85.64 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.617 -178.916 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.605 HG23 ' N ' ' A' ' 70' ' ' LEU . 27.6 m -75.24 -53.05 17.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.525 179.902 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.605 ' N ' HG23 ' A' ' 69' ' ' VAL . 69.5 mt -52.94 -38.97 62.5 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 -179.612 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 78.4 ttt180 -68.45 -42.37 78.91 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.481 178.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.548 HD21 ' NH1' ' A' ' 68' ' ' ARG . 99.1 m-20 -60.08 -52.41 65.47 Favored 'General case' 0 C--N 1.333 -0.126 0 C-N-CA 120.646 -0.422 . . . . 0.0 110.426 -179.476 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.535 HD22 ' N ' ' A' ' 73' ' ' LEU . 3.9 mm? -67.28 -39.95 86.09 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.679 178.954 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 96.61 98.55 1.89 Allowed Glycine 0 CA--C 1.523 0.575 0 N-CA-C 110.938 -0.865 . . . . 0.0 110.938 -179.493 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.9 tp -163.05 -7.39 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.816 0.341 . . . . 0.0 110.76 179.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 33.6 m -140.61 163.37 22.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.271 -179.867 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.403 HG23 ' CD2' ' A' ' 90' ' ' TYR . 37.1 t -139.96 154.39 23.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.443 179.796 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -143.45 152.2 23.91 Favored Glycine 0 CA--C 1.522 0.486 0 N-CA-C 110.802 -0.919 . . . . 0.0 110.802 179.323 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . 0.452 ' OD1' ' N ' ' A' ' 79' ' ' ASP . 3.9 p-10 . . . . . 0 N--CA 1.465 0.324 0 CA-C-O 120.667 0.27 . . . . 0.0 110.327 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 48.0 t . . . . . 0 N--CA 1.464 0.225 0 CA-C-O 120.858 0.361 . . . . 0.0 111.066 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 8.6 m-85 -108.27 126.08 52.41 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.076 178.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 38.6 m -148.65 166.72 27.49 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.365 -179.832 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 10.8 mt -61.65 152.42 30.85 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.272 -179.464 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.403 ' CD2' HG23 ' A' ' 77' ' ' VAL . 6.9 t80 -54.6 -49.43 70.48 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.43 -179.349 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 81.5 m-20 -130.99 -180.0 5.66 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 121.018 0.437 . . . . 0.0 110.373 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . 0.586 ' O ' ' HB3' ' A' ' 95' ' ' ALA . 19.1 m -95.37 -18.15 20.99 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.44 -179.879 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . 0.507 ' CG ' ' ND1' ' B' ' 223' ' ' HIS . 84.3 m-70 -43.46 -63.85 0.75 Allowed 'General case' 0 C--O 1.236 0.373 0 CA-C-O 120.978 0.418 . . . . 0.0 110.413 179.775 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 29.5 m -48.7 -35.02 6.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.189 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.586 ' HB3' ' O ' ' A' ' 92' ' ' THR . . . -64.41 -37.65 88.25 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.231 179.317 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.423 ' O ' ' OE2' ' A' ' 100' ' ' GLU . 99.1 mm-40 -63.17 -46.11 88.69 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 116.159 -0.473 . . . . 0.0 109.99 -179.894 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.804 HD21 ' HB2' ' B' ' 220' ' ' ALA . 9.0 mp -61.7 -43.52 98.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.133 -179.705 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 38.1 tp -65.47 -36.92 85.31 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.322 179.622 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . 0.548 ' CG ' HH21 ' A' ' 43' ' ' ARG . 94.7 m-20 -60.1 -45.5 92.75 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.113 -0.494 . . . . 0.0 109.895 -179.527 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.528 ' N ' ' OE1' ' A' ' 100' ' ' GLU . 0.4 OUTLIER -65.41 -53.24 45.95 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.284 -0.416 . . . . 0.0 109.997 179.586 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . 0.751 ' HB2' HD21 ' B' ' 216' ' ' LEU . . . -53.24 -43.51 67.39 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.559 -0.456 . . . . 0.0 110.221 179.41 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 3.7 mm -60.59 -47.9 90.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 C-N-CA 120.369 -0.532 . . . . 0.0 110.516 -178.82 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -63.02 -40.12 96.81 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.391 -179.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' HIS . . . . . 0.443 ' ND1' ' CG ' ' B' ' 212' ' ' HIS . 81.3 t60 -60.21 -47.15 87.16 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.744 -179.65 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 11.0 t -74.34 -38.56 63.22 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.107 0.48 . . . . 0.0 111.222 179.76 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 81.9 tt0 -59.15 -39.09 81.32 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.793 -179.069 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 57.3 t-80 . . . . . 0 N--CA 1.454 -0.242 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.215 -179.343 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 135' ' ' ASP . . . . . 0.481 ' N ' ' OD1' ' B' ' 135' ' ' ASP . 26.5 p-10 . . . . . 0 N--CA 1.464 0.226 0 CA-C-O 120.929 0.395 . . . . 0.0 110.841 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 136' ' ' SER . . . . . 0.445 ' N ' ' OD1' ' B' ' 135' ' ' ASP . 89.8 p -52.98 -50.59 63.84 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.293 179.098 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 11.2 tp-100 -61.5 -44.22 97.47 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 109.851 -0.425 . . . . 0.0 109.851 179.786 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 138' ' ' ALA . . . . . 0.522 ' O ' HG23 ' B' ' 142' ' ' VAL . . . -58.14 -29.24 65.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.23 179.763 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -72.57 -52.45 15.48 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 121.032 0.444 . . . . 0.0 110.395 179.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -64.75 -40.25 94.98 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.95 179.823 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 59.0 tt0 -64.6 -53.18 51.78 Favored 'General case' 0 C--O 1.241 0.642 0 CA-C-O 121.349 0.595 . . . . 0.0 110.859 -179.6 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 142' ' ' VAL . . . . . 0.522 HG23 ' O ' ' B' ' 138' ' ' ALA . 96.8 t -62.76 -44.49 99.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.051 179.645 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -53.72 -43.97 69.46 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 179.717 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 14.8 t -57.99 -44.42 87.13 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 179.835 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 9.9 m -63.2 -45.64 90.74 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.102 178.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 96.2 mt -64.32 -22.56 66.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.524 179.583 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 147' ' ' GLN . . . . . 0.501 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 55.1 tt0 -75.02 -55.71 5.47 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.289 179.357 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -58.09 -55.58 33.16 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.371 -179.803 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.505 ' O ' ' O ' ' B' ' 150' ' ' ALA . 93.6 mt -45.41 -35.88 3.96 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.342 -179.557 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 150' ' ' ALA . . . . . 0.505 ' O ' ' O ' ' B' ' 149' ' ' LEU . . . -56.45 -139.76 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 O-C-N 123.56 0.537 . . . . 0.0 110.518 179.5 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 151' ' ' THR . . . . . 0.449 ' O ' ' O ' ' B' ' 150' ' ' ALA . 95.7 m 57.37 114.49 0.02 OUTLIER Pre-proline 0 C--N 1.323 -0.558 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.293 179.947 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -48.99 -47.76 20.52 Favored 'Trans proline' 0 N--CA 1.493 1.474 0 C-N-CA 122.292 1.995 . . . . 0.0 112.819 -179.042 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 67.9 m -61.91 -46.78 87.88 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.29 -179.022 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 3.2 tpp180 -62.61 -47.37 84.06 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.403 -178.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 155' ' ' LEU . . . . . 0.591 HD23 ' O ' ' B' ' 155' ' ' LEU . 2.7 tt -60.74 -52.96 62.88 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.43 -178.571 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 63.0 ttp -50.42 -48.06 56.33 Favored 'General case' 0 C--O 1.238 0.488 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.243 179.718 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 5.9 mm -62.71 -44.0 99.11 Favored 'Isoleucine or valine' 0 C--O 1.238 0.497 0 CA-C-O 121.019 0.437 . . . . 0.0 110.623 179.839 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 63.3 mt -61.73 -41.7 97.99 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.532 179.541 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 9.9 m -58.0 -40.05 79.8 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.71 179.572 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 160' ' ' GLN . . . . . 0.556 HE22 HD11 ' B' ' 175' ' ' ILE . 49.9 mt-30 -63.05 -44.35 96.08 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.826 -0.35 . . . . 0.0 110.421 179.417 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 161' ' ' LEU . . . . . 0.466 ' O ' ' N ' ' B' ' 163' ' ' ASN . 76.7 mt -62.83 -31.76 72.83 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.142 179.502 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 162' ' ' ARG . . . . . 0.524 HH21 ' CG ' ' B' ' 218' ' ' ASP . 33.4 tpt85 -34.58 -33.69 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 O-C-N 123.548 0.53 . . . . 0.0 110.959 -179.612 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 163' ' ' ASN . . . . . 0.466 ' N ' ' O ' ' B' ' 161' ' ' LEU . 86.9 m-20 -70.13 -83.0 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.293 179.671 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . 147.92 -76.05 0.26 Allowed Glycine 0 CA--C 1.525 0.675 0 N-CA-C 110.933 -0.867 . . . . 0.0 110.933 179.921 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -68.36 84.41 0.47 Allowed 'Trans proline' 0 N--CA 1.496 1.62 0 C-N-CA 122.71 2.274 . . . . 0.0 112.298 -179.721 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -157.02 66.72 3.99 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.101 0.477 . . . . 0.0 110.169 -179.552 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -44.51 171.36 0.02 OUTLIER 'Trans proline' 0 C--N 1.299 -2.053 0 C-N-CA 122.452 2.101 . . . . 0.0 112.143 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . 83.0 t -54.26 -46.57 68.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.324 -179.409 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 169' ' ' THR . . . . . . . . . . . . . 12.6 m -61.6 -37.81 85.29 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.274 0.559 . . . . 0.0 110.417 179.272 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -67.01 -40.55 87.32 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.133 179.78 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 171' ' ' LEU . . . . . 0.624 ' O ' HD13 ' B' ' 171' ' ' LEU . 0.2 OUTLIER -62.73 -42.07 99.49 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.9 -179.933 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 172' ' ' ALA . . . . . 0.575 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -56.54 -48.47 77.22 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 179.406 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -54.56 -43.95 72.48 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.013 179.592 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -56.95 -55.85 29.29 Favored 'General case' 0 C--O 1.232 0.154 0 C-N-CA 120.696 -0.402 . . . . 0.0 110.687 179.698 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 175' ' ' ILE . . . . . 0.556 HD11 HE22 ' B' ' 160' ' ' GLN . 89.7 mt -81.97 -68.66 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.299 179.497 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 176' ' ' GLY . . . . . 0.575 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 132.33 72.71 0.1 OUTLIER Glycine 0 CA--C 1.52 0.37 0 N-CA-C 110.962 -0.855 . . . . 0.0 110.962 179.742 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 177' ' ' MET . . . . . 0.474 ' CB ' ' O ' ' B' ' 176' ' ' GLY . 1.2 tmm? 79.86 96.47 0.06 Allowed 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 120.914 -0.314 . . . . 0.0 110.794 179.517 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -174.5 34.18 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.202 179.799 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -68.54 -23.29 64.51 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.899 -179.484 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 69.8 p -66.45 -44.88 81.6 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.055 -179.75 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -62.59 -34.99 78.11 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.382 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 97.9 t -66.98 -52.34 45.01 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.225 0 C-N-CA 120.602 -0.439 . . . . 0.0 110.509 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 50.0 m -55.21 -43.89 74.85 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.57 -0.452 . . . . 0.0 110.455 -179.684 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 184' ' ' HIS . . . . . 0.453 ' O ' HG22 ' B' ' 188' ' ' VAL . 77.7 m-70 -67.78 -42.91 80.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.034 179.756 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 69.7 mt-30 -62.74 -39.97 95.77 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.338 -179.848 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -67.93 -40.59 83.3 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 120.993 0.425 . . . . 0.0 110.592 178.871 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 187' ' ' ARG . . . . . 0.643 ' NH1' HD21 ' B' ' 191' ' ' ASN . 16.8 tpt85 -58.65 -46.31 87.41 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.712 -178.737 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 188' ' ' VAL . . . . . 0.595 HG23 ' N ' ' B' ' 189' ' ' LEU . 29.4 m -75.85 -52.59 17.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.537 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 189' ' ' LEU . . . . . 0.595 ' N ' HG23 ' B' ' 188' ' ' VAL . 72.1 mt -53.53 -39.91 65.07 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.161 -0.472 . . . . 0.0 109.746 -179.793 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 77.3 ttt180 -67.16 -43.18 82.93 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.453 179.038 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 191' ' ' ASN . . . . . 0.643 HD21 ' NH1' ' B' ' 187' ' ' ARG . 93.8 m-20 -59.35 -51.66 68.95 Favored 'General case' 0 C--O 1.23 0.071 0 C-N-CA 120.553 -0.459 . . . . 0.0 110.395 -179.407 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 192' ' ' LEU . . . . . 0.498 ' N ' HD22 ' B' ' 192' ' ' LEU . 4.1 mm? -68.12 -39.34 82.79 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.83 178.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 96.05 97.89 1.81 Allowed Glycine 0 CA--C 1.522 0.522 0 N-CA-C 110.915 -0.874 . . . . 0.0 110.915 -179.58 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 194' ' ' LEU . . . . . 0.414 ' H ' ' H ' ' B' ' 195' ' ' VAL . 4.2 tp -162.19 -9.0 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.904 0.383 . . . . 0.0 110.716 179.791 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 195' ' ' VAL . . . . . 0.414 ' H ' ' H ' ' B' ' 194' ' ' LEU . 34.4 m -139.42 161.65 27.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.382 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 196' ' ' VAL . . . . . 0.422 HG23 ' CD2' ' B' ' 209' ' ' TYR . 41.1 t -139.8 154.52 24.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 121.043 0.449 . . . . 0.0 110.473 179.892 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 197' ' ' GLY . . . . . 0.402 ' N ' ' CG1' ' B' ' 196' ' ' VAL . . . -143.21 153.09 24.56 Favored Glycine 0 CA--C 1.519 0.334 0 N-CA-C 111.002 -0.839 . . . . 0.0 111.002 179.505 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 198' ' ' ASP . . . . . 0.434 ' N ' ' OD1' ' B' ' 198' ' ' ASP . 5.8 p-10 . . . . . 0 N--CA 1.464 0.247 0 CA-C-O 120.83 0.348 . . . . 0.0 110.456 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 58.8 t . . . . . 0 N--CA 1.463 0.187 0 CA-C-O 120.979 0.419 . . . . 0.0 110.686 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -107.24 129.81 54.82 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.655 179.207 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 49.2 m -150.59 168.56 23.9 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.361 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 208' ' ' LEU . . . . . 0.403 ' H ' ' HG ' ' B' ' 208' ' ' LEU . 18.1 mt -63.21 152.12 38.45 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.376 -179.65 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 209' ' ' TYR . . . . . 0.422 ' CD2' HG23 ' B' ' 196' ' ' VAL . 6.4 t80 -55.04 -48.71 73.07 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.368 -179.343 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 84.3 m-20 -132.88 177.84 7.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.936 0.398 . . . . 0.0 110.402 -179.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 211' ' ' THR . . . . . 0.625 ' O ' ' HB3' ' B' ' 214' ' ' ALA . 24.3 m -92.83 -20.02 21.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.457 -179.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 212' ' ' HIS . . . . . 0.443 ' CG ' ' ND1' ' A' ' 104' ' ' HIS . 83.7 m-70 -41.24 -65.44 0.43 Allowed 'General case' 0 C--O 1.237 0.429 0 CA-C-O 120.912 0.387 . . . . 0.0 110.557 179.876 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 22.8 m -47.88 -34.06 4.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.199 179.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 214' ' ' ALA . . . . . 0.625 ' HB3' ' O ' ' B' ' 211' ' ' THR . . . -65.04 -38.34 90.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.255 179.205 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 215' ' ' GLN . . . . . 0.412 ' O ' ' OE2' ' B' ' 219' ' ' GLU . 99.4 mm-40 -62.09 -46.99 86.64 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 121.056 0.455 . . . . 0.0 110.095 -179.908 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 216' ' ' LEU . . . . . 0.751 HD21 ' HB2' ' A' ' 101' ' ' ALA . 8.0 mp -61.01 -42.64 98.84 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.27 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 217' ' ' LEU . . . . . 0.402 HD12 ' HA ' ' B' ' 217' ' ' LEU . 45.7 tp -65.86 -37.34 85.93 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.383 179.523 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 218' ' ' ASP . . . . . 0.524 ' CG ' HH21 ' B' ' 162' ' ' ARG . 99.5 m-20 -59.9 -43.8 94.63 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.17 -0.468 . . . . 0.0 109.957 -179.469 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 219' ' ' GLU . . . . . 0.497 ' OE1' ' N ' ' B' ' 219' ' ' GLU . 0.6 OUTLIER -67.94 -52.12 39.74 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.15 179.344 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 220' ' ' ALA . . . . . 0.804 ' HB2' HD21 ' A' ' 97' ' ' LEU . . . -53.22 -44.22 67.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.166 179.477 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 4.9 mm -61.61 -45.9 97.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 C-N-CA 120.312 -0.555 . . . . 0.0 110.876 -179.34 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -63.36 -39.82 95.57 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.499 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 223' ' ' HIS . . . . . 0.507 ' ND1' ' CG ' ' A' ' 93' ' ' HIS . 81.5 t60 -60.85 -46.77 89.28 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.728 -179.832 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 10.5 t -73.91 -39.81 63.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.156 179.65 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -56.94 -40.19 75.92 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.653 -179.252 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 53.2 t-80 . . . . . 0 N--CA 1.455 -0.216 0 C-N-CA 120.568 -0.453 . . . . 0.0 110.338 -179.181 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 . . . . . 0 C--O 1.236 0.389 0 CA-C-O 121.294 0.568 . . . . 0.0 110.994 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 93.4 p -58.77 -33.67 70.57 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.279 -179.424 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 54.3 mt-30 -68.59 -48.22 64.73 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.439 179.52 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.5 ' O ' HG23 ' A' ' 23' ' ' VAL . . . -55.68 -38.42 69.6 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 -179.81 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.64 -53.13 45.68 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 120.996 0.427 . . . . 0.0 110.259 179.606 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.98 -43.37 95.16 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 120.702 -0.399 . . . . 0.0 110.842 -179.859 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -64.17 -53.13 54.28 Favored 'General case' 0 C--O 1.242 0.665 0 CA-C-O 121.394 0.616 . . . . 0.0 111.045 -179.463 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.5 HG23 ' O ' ' A' ' 19' ' ' ALA . 96.0 t -61.73 -45.48 98.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.183 179.801 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.13 -41.3 83.39 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 179.853 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 45.6 t -57.08 -45.33 83.42 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 -179.724 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.428 ' OG1' ' O ' ' A' ' 23' ' ' VAL . 20.8 p -65.56 -44.68 86.02 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 120.755 -0.378 . . . . 0.0 110.497 178.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 96.1 mt -64.42 -23.72 67.38 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.661 179.482 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.51 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 57.0 tt0 -75.14 -57.38 3.93 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.54 179.543 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.26 -54.55 45.77 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 120.61 -0.436 . . . . 0.0 110.466 -179.417 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.489 ' O ' ' O ' ' A' ' 31' ' ' ALA . 88.7 mt -46.08 -34.62 4.27 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.27 -179.55 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.51 ' HB3' ' O ' ' A' ' 28' ' ' GLN . . . -57.03 -129.44 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 O-C-N 123.642 0.589 . . . . 0.0 110.364 179.437 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.467 ' HG1' ' HB2' ' A' ' 35' ' ' ARG . 0.3 OUTLIER 52.8 108.31 0.02 OUTLIER Pre-proline 0 CA--C 1.54 0.572 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.331 179.561 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_exo -45.8 -59.91 1.03 Allowed 'Trans proline' 0 C--N 1.309 -1.523 0 C-N-CA 122.166 1.91 . . . . 0.0 112.882 -179.217 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 50.8 m -54.86 -45.7 74.61 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.869 -178.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.467 ' HB2' ' HG1' ' A' ' 32' ' ' THR . 46.0 mmm-85 -61.79 -44.76 96.23 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.027 -179.582 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.594 HD23 ' O ' ' A' ' 36' ' ' LEU . 2.0 tt -63.11 -49.0 76.16 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.423 -179.342 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 28.6 ttt -52.1 -48.53 64.72 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.242 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.406 HG13 HE22 ' A' ' 66' ' ' GLN . 38.2 mm -63.63 -43.4 98.14 Favored 'Isoleucine or valine' 0 C--O 1.244 0.801 0 CA-C-O 121.189 0.519 . . . . 0.0 110.574 179.542 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 15.7 tp -61.76 -41.28 97.48 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.225 -179.55 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 19.6 m -61.27 -42.41 98.58 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 179.364 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 10.6 tp-100 -54.34 -48.06 71.84 Favored 'General case' 0 C--O 1.233 0.19 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 17.2 mt -64.29 -40.15 95.38 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.509 -0.476 . . . . 0.0 111.087 178.774 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.405 HH21 HD13 ' A' ' 98' ' ' LEU . 30.1 ttm180 -46.03 -25.51 0.58 Allowed 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.35 -179.186 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -61.59 -39.84 92.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.582 -179.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 157.66 -176.89 34.67 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.911 -0.876 . . . . 0.0 110.911 179.846 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -78.35 117.9 4.17 Favored 'Trans proline' 0 C--N 1.309 -1.501 0 C-N-CA 122.885 2.39 . . . . 0.0 111.67 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.541 HD12 ' O ' ' A' ' 47' ' ' LEU . 0.3 OUTLIER -148.75 128.25 6.39 Favored Pre-proline 0 CA--C 1.543 0.693 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.368 -179.58 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -47.53 167.28 0.09 OUTLIER 'Trans proline' 0 C--N 1.307 -1.613 0 C-N-CA 122.266 1.978 . . . . 0.0 112.475 178.745 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.424 ' CG2' ' N ' ' A' ' 50' ' ' THR . 2.4 m -61.06 -37.36 77.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-O 121.586 0.708 . . . . 0.0 110.518 179.91 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.424 ' N ' ' CG2' ' A' ' 49' ' ' VAL . 26.9 m -59.99 -44.93 94.19 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 115.029 -0.987 . . . . 0.0 110.386 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 55.4 m-20 -66.21 -39.33 89.55 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.122 178.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.652 HD23 ' O ' ' A' ' 52' ' ' LEU . 4.8 tt -61.55 -42.51 98.94 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.795 -179.886 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.563 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -60.75 -43.85 97.45 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 179.719 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -55.14 -44.79 75.4 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.63 -0.428 . . . . 0.0 109.878 179.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -62.53 -39.67 94.33 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.731 -0.388 . . . . 0.0 110.602 179.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.504 HD12 ' CD2' ' A' ' 52' ' ' LEU . 90.9 mt -94.38 -78.08 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.239 179.577 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . 0.563 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 150.11 83.55 0.04 OUTLIER Glycine 0 CA--C 1.521 0.408 0 N-CA-C 111.663 -0.575 . . . . 0.0 111.663 179.622 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.407 ' O ' ' OE1' ' A' ' 59' ' ' GLU . 87.1 mtp 57.49 103.32 0.02 OUTLIER 'General case' 0 CA--C 1.518 -0.283 0 CA-C-O 121.015 0.436 . . . . 0.0 111.047 179.008 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.407 ' OE1' ' O ' ' A' ' 58' ' ' MET . 3.6 tp10 -174.86 32.74 0.01 OUTLIER 'General case' 0 N--CA 1.456 -0.132 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.298 179.78 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 -63.1 -23.85 67.63 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.057 -178.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 78.0 p -71.06 -43.73 67.19 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.087 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.07 -29.7 70.82 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.174 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 92.4 t -74.45 -52.07 20.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 C-N-CA 120.809 -0.356 . . . . 0.0 110.615 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 67.9 p -56.03 -45.43 79.16 Favored 'General case' 0 C--O 1.233 0.192 0 C-N-CA 120.533 -0.467 . . . . 0.0 110.651 -179.77 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 73.6 m-70 -66.25 -50.9 62.17 Favored 'General case' 0 C--O 1.242 0.662 0 CA-C-O 121.171 0.51 . . . . 0.0 111.235 -179.866 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . 0.406 HE22 HG13 ' A' ' 38' ' ' ILE . 79.9 mt-30 -58.34 -31.56 67.69 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.245 179.458 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.416 ' O ' ' CG ' ' A' ' 71' ' ' ARG . 5.1 tp -69.65 -43.39 72.71 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.446 179.931 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 82.3 mtp180 -60.19 -49.75 76.4 Favored 'General case' 0 C--O 1.245 0.843 0 CA-C-O 121.512 0.673 . . . . 0.0 111.167 -179.298 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.593 HG13 ' N ' ' A' ' 70' ' ' LEU . 4.4 p -66.2 -54.55 25.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.349 179.523 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.593 ' N ' HG13 ' A' ' 69' ' ' VAL . 70.8 mt -54.17 -35.23 62.07 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 -179.65 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.416 ' CG ' ' O ' ' A' ' 67' ' ' LEU . 11.9 mmm180 -61.78 -40.46 95.29 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.651 179.148 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -62.78 -42.97 99.93 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.075 -179.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.485 HD23 ' N ' ' A' ' 73' ' ' LEU . 6.9 mt -67.61 -42.34 82.57 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.422 -179.496 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 100.9 37.54 3.63 Favored Glycine 0 CA--C 1.522 0.483 0 N-CA-C 111.22 -0.752 . . . . 0.0 111.22 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -100.43 -15.37 17.95 Favored 'General case' 0 CA--C 1.512 -0.483 0 O-C-N 122.825 -0.221 . . . . 0.0 110.897 179.534 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 23.2 m -136.57 158.58 37.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-O 120.846 0.355 . . . . 0.0 110.049 -179.815 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.432 ' CG1' ' N ' ' A' ' 78' ' ' GLY . 40.1 t -142.48 156.53 18.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.622 179.836 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . 0.432 ' N ' ' CG1' ' A' ' 77' ' ' VAL . . . -105.13 167.68 15.18 Favored Glycine 0 CA--C 1.522 0.524 0 N-CA-C 110.309 -1.116 . . . . 0.0 110.309 179.555 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 68.0 t0 . . . . . 0 C--N 1.329 -0.289 0 CA-C-O 120.602 0.239 . . . . 0.0 110.568 -179.374 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.41 HG12 ' N ' ' A' ' 87' ' ' TYR . 18.6 t . . . . . 0 C--O 1.224 -0.262 0 CA-C-O 120.732 0.301 . . . . 0.0 110.403 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.41 ' N ' HG12 ' A' ' 86' ' ' VAL . 44.2 m-85 -106.0 136.64 45.3 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.532 -179.496 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 94.8 p -151.91 172.7 15.82 Favored 'General case' 0 C--O 1.224 -0.289 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.423 -179.798 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 56.3 mt -65.41 148.2 52.12 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.656 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.413 ' CD2' HG23 ' A' ' 77' ' ' VAL . 10.2 t80 -52.71 -48.5 66.59 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.312 -179.456 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 46.5 p-10 -146.77 -179.78 7.03 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.781 0.324 . . . . 0.0 110.555 -179.857 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . 0.453 ' O ' ' HB3' ' A' ' 95' ' ' ALA . 42.0 p -88.7 -16.34 32.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.558 -179.844 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 58.4 m80 -46.88 -65.38 0.57 Allowed 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.048 0.452 . . . . 0.0 110.697 -179.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 11.9 p -52.79 -35.25 21.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.193 -179.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.453 ' HB3' ' O ' ' A' ' 92' ' ' THR . . . -62.97 -40.35 97.44 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.411 179.493 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -63.55 -44.45 94.12 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 116.013 -0.54 . . . . 0.0 109.895 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 13.9 tp -60.02 -42.71 94.94 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.158 -179.835 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.405 HD13 HH21 ' A' ' 43' ' ' ARG . 87.5 mt -63.39 -39.2 93.87 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.154 179.801 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -60.28 -42.86 96.33 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.103 -179.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 73.8 mm-40 -67.72 -47.69 68.64 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.542 179.617 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.14 -44.29 92.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.262 -0.426 . . . . 0.0 109.949 179.684 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 5.0 mm -62.94 -44.13 99.43 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.639 -179.561 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -60.08 -42.19 94.07 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.998 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 35.0 m170 -68.77 -35.96 77.72 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.245 179.788 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 7.0 t -59.02 -47.98 83.25 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.322 -179.692 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -74.8 -57.28 4.01 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.003 0.43 . . . . 0.0 110.431 179.465 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 53.3 m170 . . . . . 0 C--N 1.331 -0.229 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.043 -179.867 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 . . . . . 0 N--CA 1.466 0.37 0 CA-C-O 120.963 0.411 . . . . 0.0 110.591 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 11.2 t -59.14 -48.79 80.32 Favored 'General case' 0 C--O 1.24 0.585 0 CA-C-O 121.189 0.519 . . . . 0.0 110.711 178.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 73.8 mt-30 -64.53 -42.78 95.55 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.948 -179.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 138' ' ' ALA . . . . . 0.492 ' O ' HG23 ' B' ' 142' ' ' VAL . . . -55.83 -38.86 70.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.08 -179.891 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -65.36 -53.25 46.25 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 120.933 0.396 . . . . 0.0 110.242 179.552 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -60.52 -41.85 95.22 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.532 -0.467 . . . . 0.0 110.879 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 59.5 tt0 -64.35 -53.71 44.43 Favored 'General case' 0 C--O 1.244 0.773 0 CA-C-O 121.415 0.626 . . . . 0.0 111.025 -179.573 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 142' ' ' VAL . . . . . 0.492 HG23 ' O ' ' B' ' 138' ' ' ALA . 89.4 t -62.17 -45.68 98.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.006 179.684 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -57.27 -42.09 80.97 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 44.2 t -56.58 -45.84 81.11 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 -179.725 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 145' ' ' THR . . . . . 0.458 ' OG1' ' O ' ' B' ' 142' ' ' VAL . 21.7 p -65.16 -44.02 89.89 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 120.65 -0.42 . . . . 0.0 110.54 179.078 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 95.9 mt -64.37 -24.05 67.5 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.598 179.455 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 147' ' ' GLN . . . . . 0.506 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 55.9 tt0 -75.38 -57.05 4.13 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.536 179.607 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -57.95 -54.67 44.32 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.599 -179.32 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.501 ' O ' ' O ' ' B' ' 150' ' ' ALA . 92.9 mt -46.29 -35.56 5.43 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.319 -179.66 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 150' ' ' ALA . . . . . 0.506 ' HB3' ' O ' ' B' ' 147' ' ' GLN . . . -56.69 -131.43 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.262 0.553 . . . . 0.0 110.407 179.6 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 151' ' ' THR . . . . . 0.532 ' HG1' ' HB2' ' B' ' 154' ' ' ARG . 0.4 OUTLIER 54.61 108.61 0.02 OUTLIER Pre-proline 0 CA--C 1.539 0.539 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.322 179.503 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -45.58 -61.45 0.59 Allowed 'Trans proline' 0 C--N 1.31 -1.494 0 C-N-CA 122.304 2.003 . . . . 0.0 112.868 -179.11 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 49.6 m -53.96 -46.7 71.69 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.0 -178.591 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 154' ' ' ARG . . . . . 0.532 ' HB2' ' HG1' ' B' ' 151' ' ' THR . 46.0 mmm-85 -60.46 -44.09 96.23 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 120.716 -0.394 . . . . 0.0 111.011 -179.502 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 155' ' ' LEU . . . . . 0.59 HD23 ' O ' ' B' ' 155' ' ' LEU . 1.9 tt -64.18 -49.16 73.14 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.31 -179.389 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 28.6 ttt -51.61 -49.05 62.93 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.241 -179.459 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 42.8 mm -64.24 -43.69 97.3 Favored 'Isoleucine or valine' 0 C--O 1.247 0.931 0 CA-C-O 121.188 0.518 . . . . 0.0 110.437 179.737 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 17.6 tp -60.84 -42.1 97.11 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.262 -179.516 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 19.0 m -61.57 -41.59 97.62 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.858 179.383 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 10.4 tp-100 -53.45 -49.29 67.7 Favored 'General case' 0 C--O 1.233 0.202 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 161' ' ' LEU . . . . . 0.464 ' O ' ' N ' ' B' ' 163' ' ' ASN . 8.9 mt -64.29 -40.65 96.39 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.288 -0.565 . . . . 0.0 111.153 179.054 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 162' ' ' ARG . . . . . 0.462 HH21 HD13 ' B' ' 217' ' ' LEU . 32.6 ttm180 -42.14 -23.56 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.287 -179.213 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 163' ' ' ASN . . . . . 0.464 ' N ' ' O ' ' B' ' 161' ' ' LEU . 7.7 m120 -63.06 -41.46 99.46 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.624 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 164' ' ' GLY . . . . . 0.401 ' N ' ' O ' ' B' ' 161' ' ' LEU . . . 155.83 -170.36 33.65 Favored Glycine 0 CA--C 1.522 0.484 0 N-CA-C 111.09 -0.804 . . . . 0.0 111.09 179.523 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -74.24 120.27 6.2 Favored 'Trans proline' 0 N--CA 1.495 1.594 0 C-N-CA 122.916 2.411 . . . . 0.0 111.849 179.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 166' ' ' LEU . . . . . 0.5 ' O ' HD12 ' B' ' 166' ' ' LEU . 0.2 OUTLIER -151.92 120.91 3.39 Favored Pre-proline 0 CA--C 1.545 0.768 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.633 179.843 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -47.6 168.67 0.07 OUTLIER 'Trans proline' 0 C--N 1.304 -1.788 0 C-N-CA 122.26 1.974 . . . . 0.0 112.317 178.633 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 168' ' ' VAL . . . . . 0.438 HG13 ' H ' ' B' ' 168' ' ' VAL . 2.6 m -60.46 -37.75 75.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-O 121.698 0.761 . . . . 0.0 110.41 179.875 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 169' ' ' THR . . . . . 0.42 ' N ' ' CG2' ' B' ' 168' ' ' VAL . 14.0 m -60.7 -45.65 93.37 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 115.058 -0.973 . . . . 0.0 110.192 -179.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 71.5 m-20 -65.11 -41.15 95.17 Favored 'General case' 0 C--O 1.241 0.639 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.077 179.314 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 171' ' ' LEU . . . . . 0.59 HD23 ' O ' ' B' ' 171' ' ' LEU . 4.5 tt -61.32 -41.71 97.46 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.936 -179.541 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 172' ' ' ALA . . . . . 0.549 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -60.77 -44.03 97.28 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 179.649 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -55.26 -44.52 75.66 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.275 -0.42 . . . . 0.0 109.897 179.773 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -61.92 -41.04 97.47 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.47 179.623 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 175' ' ' ILE . . . . . 0.482 HD12 ' CD2' ' B' ' 171' ' ' LEU . 96.7 mt -93.52 -79.04 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.183 179.486 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 176' ' ' GLY . . . . . 0.549 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 151.84 82.43 0.04 OUTLIER Glycine 0 CA--C 1.52 0.388 0 N-CA-C 111.518 -0.633 . . . . 0.0 111.518 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 177' ' ' MET . . . . . 0.435 ' O ' ' OE1' ' B' ' 178' ' ' GLU . 89.0 mtp 58.34 105.37 0.02 OUTLIER 'General case' 0 CA--C 1.518 -0.253 0 CA-C-O 120.853 0.359 . . . . 0.0 110.995 179.076 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 178' ' ' GLU . . . . . 0.435 ' OE1' ' O ' ' B' ' 177' ' ' MET . 4.0 tp10 -176.87 32.75 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.28 179.75 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 7.5 mt-30 -62.84 -23.8 67.46 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.031 -179.005 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 78.7 p -70.95 -42.45 69.79 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.968 -179.697 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -65.71 -28.91 69.4 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.299 -179.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 97.9 t -74.8 -52.47 19.14 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.126 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.547 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 79.4 p -56.32 -43.8 79.34 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 120.541 -0.464 . . . . 0.0 110.366 -179.699 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 64.5 m-70 -66.84 -50.93 60.99 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-O 121.163 0.506 . . . . 0.0 111.078 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -58.8 -31.48 68.46 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.214 179.507 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 186' ' ' LEU . . . . . 0.415 ' O ' ' CG ' ' B' ' 190' ' ' ARG . 5.1 tp -69.77 -43.46 72.15 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.549 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 81.3 mtp180 -60.02 -49.17 78.71 Favored 'General case' 0 C--O 1.246 0.876 0 CA-C-O 121.293 0.568 . . . . 0.0 111.144 -179.376 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 188' ' ' VAL . . . . . 0.588 HG13 ' N ' ' B' ' 189' ' ' LEU . 4.9 p -67.05 -54.39 24.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.243 179.726 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 189' ' ' LEU . . . . . 0.588 ' N ' HG13 ' B' ' 188' ' ' VAL . 73.4 mt -54.21 -35.63 62.6 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 -179.657 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 190' ' ' ARG . . . . . 0.415 ' CG ' ' O ' ' B' ' 186' ' ' LEU . 12.6 mmm180 -61.36 -40.56 94.76 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.63 179.12 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -62.92 -42.58 99.85 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 120.37 -0.532 . . . . 0.0 109.969 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 192' ' ' LEU . . . . . 0.494 HD23 ' N ' ' B' ' 192' ' ' LEU . 7.2 mt -67.91 -38.29 82.78 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.42 -179.542 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 95.9 35.28 5.64 Favored Glycine 0 CA--C 1.521 0.427 0 N-CA-C 111.23 -0.748 . . . . 0.0 111.23 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -98.4 -15.89 19.5 Favored 'General case' 0 CA--C 1.512 -0.511 0 O-C-N 122.916 -0.167 . . . . 0.0 111.079 179.558 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 26.5 m -136.4 158.44 37.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.11 -179.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 196' ' ' VAL . . . . . 0.44 ' CG1' ' N ' ' B' ' 197' ' ' GLY . 41.2 t -142.77 156.76 18.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.595 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 197' ' ' GLY . . . . . 0.44 ' N ' ' CG1' ' B' ' 196' ' ' VAL . . . -106.08 168.69 15.13 Favored Glycine 0 CA--C 1.523 0.572 0 N-CA-C 110.418 -1.073 . . . . 0.0 110.418 179.6 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 67.9 t0 . . . . . 0 C--N 1.328 -0.345 0 CA-C-O 120.769 0.319 . . . . 0.0 110.559 -179.654 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 205' ' ' VAL . . . . . 0.448 HG12 ' N ' ' B' ' 206' ' ' TYR . 21.4 t . . . . . 0 N--CA 1.466 0.364 0 N-CA-C 110.391 -0.226 . . . . 0.0 110.391 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 206' ' ' TYR . . . . . 0.448 ' N ' HG12 ' B' ' 205' ' ' VAL . 45.0 m-85 -108.77 135.5 49.89 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.332 -179.668 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 83.5 p -151.56 172.06 16.62 Favored 'General case' 0 C--O 1.224 -0.289 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.429 -179.759 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . 55.3 mt -65.63 149.12 50.61 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.529 -179.764 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 209' ' ' TYR . . . . . 0.418 ' CD2' HG23 ' B' ' 196' ' ' VAL . 11.7 t80 -52.44 -48.72 65.61 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.326 -179.631 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 42.5 p-10 -146.74 -178.94 6.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.77 0.319 . . . . 0.0 110.559 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 211' ' ' THR . . . . . 0.476 ' O ' ' HB3' ' B' ' 214' ' ' ALA . 30.7 p -88.97 -17.04 30.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.374 -179.755 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 212' ' ' HIS . . . . . . . . . . . . . 46.3 m80 -45.12 -65.21 0.56 Allowed 'General case' 0 C--O 1.237 0.419 0 CA-C-O 121.045 0.45 . . . . 0.0 110.701 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 10.7 p -53.05 -35.64 23.05 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.178 -179.823 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 214' ' ' ALA . . . . . 0.476 ' HB3' ' O ' ' B' ' 211' ' ' THR . . . -62.09 -41.96 98.73 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.392 179.55 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -62.51 -45.12 94.43 Favored 'General case' 0 C--O 1.238 0.459 0 CA-C-N 116.172 -0.467 . . . . 0.0 109.894 -179.917 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 216' ' ' LEU . . . . . . . . . . . . . 18.4 tp -60.01 -42.38 94.16 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.06 -179.648 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 217' ' ' LEU . . . . . 0.462 HD13 HH21 ' B' ' 162' ' ' ARG . 79.1 mt -63.72 -39.76 95.1 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.306 179.745 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 97.0 m-20 -59.66 -42.91 93.89 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.176 -179.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 219' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -67.16 -49.11 65.89 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.779 -0.368 . . . . 0.0 110.634 179.446 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -57.69 -44.99 86.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.285 -0.416 . . . . 0.0 109.924 179.689 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 4.8 mm -62.34 -43.98 98.7 Favored 'Isoleucine or valine' 0 C--O 1.237 0.442 0 CA-C-O 121.148 0.499 . . . . 0.0 110.612 -179.457 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -60.68 -42.22 96.66 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.937 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 223' ' ' HIS . . . . . . . . . . . . . 46.7 m170 -68.88 -36.3 77.91 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.113 179.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 43.0 t -58.73 -47.71 83.65 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.262 -179.673 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -74.9 -57.22 4.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.993 0.425 . . . . 0.0 110.586 179.236 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 59.2 m170 . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.125 -179.809 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 95.0 m-20 . . . . . 0 C--O 1.239 0.55 0 CA-C-O 121.258 0.552 . . . . 0.0 110.802 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 37.7 t -57.55 -42.75 83.57 Favored 'General case' 0 C--O 1.239 0.547 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.124 -179.552 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 9.1 mm100 -66.49 -42.66 87.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.28 179.521 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.527 ' O ' HG23 ' A' ' 23' ' ' VAL . . . -51.74 -48.11 63.77 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 -179.209 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.34 -53.98 49.69 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 120.387 -0.525 . . . . 0.0 110.308 179.07 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -52.6 -48.24 66.41 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.03 179.803 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 85.8 mm-40 -56.32 -50.03 72.61 Favored 'General case' 0 C--O 1.241 0.614 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.688 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.527 HG23 ' O ' ' A' ' 19' ' ' ALA . 84.2 t -60.12 -37.66 73.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.813 179.686 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.682 ' HB2' HD12 ' B' ' 155' ' ' LEU . . . -64.86 -42.07 95.16 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.411 178.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 67.1 m -56.9 -49.69 74.8 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.935 0.398 . . . . 0.0 110.99 -178.693 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.414 HG23 ' N ' ' A' ' 27' ' ' LEU . 1.4 t -65.65 -48.68 71.32 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.725 179.832 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.414 ' N ' HG23 ' A' ' 26' ' ' THR . 69.1 mt -62.01 -26.06 68.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.946 179.758 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.667 ' NE2' ' NE2' ' B' ' 147' ' ' GLN . 29.6 tp60 -72.88 -60.12 2.38 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.352 179.224 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -55.64 -53.97 49.9 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.714 -179.189 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.511 ' O ' ' O ' ' A' ' 31' ' ' ALA . 7.3 mp -46.56 -35.45 5.83 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.397 -179.192 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.511 ' O ' ' O ' ' A' ' 30' ' ' LEU . . . -57.47 -132.69 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.45 0 O-C-N 123.52 0.512 . . . . 0.0 110.022 179.468 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.47 ' O ' ' O ' ' A' ' 31' ' ' ALA . 0.8 OUTLIER 54.43 113.04 0.01 OUTLIER Pre-proline 0 CA--C 1.542 0.661 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.39 179.495 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -50.45 -57.58 2.2 Favored 'Trans proline' 0 N--CA 1.495 1.609 0 C-N-CA 122.283 1.989 . . . . 0.0 113.282 -179.541 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 80.5 p -52.8 -46.09 67.52 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.22 -178.175 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 10.7 mpt_? -61.97 -42.67 99.4 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.637 -179.61 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.697 HD12 ' HB2' ' B' ' 143' ' ' ALA . 5.1 mt -61.37 -51.92 66.8 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 120.35 -0.54 . . . . 0.0 110.841 -179.159 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 11.2 tpt -53.83 -49.35 68.59 Favored 'General case' 0 C--O 1.24 0.574 0 C-N-CA 120.279 -0.568 . . . . 0.0 110.224 -179.62 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 96.7 mt -62.88 -45.58 98.5 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 CA-C-O 121.568 0.699 . . . . 0.0 110.405 -179.596 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 53.5 mt -62.21 -38.12 87.94 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.721 179.504 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 18.0 m -59.41 -41.8 90.3 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.996 179.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.853 HE22 HD11 ' A' ' 52' ' ' LEU . 0.0 OUTLIER -57.99 -43.82 86.8 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.282 -0.567 . . . . 0.0 110.269 179.839 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.587 ' N ' ' HG2' ' A' ' 41' ' ' GLN . 15.0 mt -64.19 -38.17 90.1 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.323 -179.411 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 73.6 ttp85 -51.0 -39.22 55.18 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.477 -179.402 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 51.4 t-20 -56.25 -39.55 72.77 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.411 -179.313 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 153.06 175.02 24.05 Favored Glycine 0 CA--C 1.524 0.595 0 N-CA-C 111.016 -0.834 . . . . 0.0 111.016 179.73 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -70.25 142.04 44.76 Favored 'Trans proline' 0 C--N 1.308 -1.6 0 C-N-CA 122.694 2.263 . . . . 0.0 111.764 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.519 HD12 ' O ' ' A' ' 47' ' ' LEU . 0.3 OUTLIER -162.81 160.62 19.44 Favored Pre-proline 0 C--N 1.326 -0.441 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.684 -179.838 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -63.26 142.01 84.47 Favored 'Trans proline' 0 N--CA 1.495 1.565 0 C-N-CA 122.519 2.146 . . . . 0.0 112.341 179.086 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 46.6 t -62.28 -43.16 97.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.423 179.457 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 89.6 m -55.86 -69.28 0.15 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.825 -179.317 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 63.1 t0 -52.23 -40.67 61.93 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.226 0.536 . . . . 0.0 109.719 -179.33 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.853 HD11 HE22 ' A' ' 41' ' ' GLN . 2.9 tm? -59.02 -48.22 82.38 Favored 'General case' 0 C--N 1.316 -0.875 0 C-N-CA 119.732 -0.787 . . . . 0.0 110.336 -179.451 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.578 ' O ' ' N ' ' A' ' 58' ' ' MET . . . -56.34 -39.23 72.49 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.358 0.599 . . . . 0.0 110.315 -179.333 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -65.04 -28.8 69.73 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.592 179.476 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . 0.401 ' HB3' ' O ' ' A' ' 52' ' ' LEU . . . -63.28 -43.42 97.98 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.923 179.928 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.43 HG23 ' N ' ' A' ' 57' ' ' GLY . 8.5 tt -164.14 -36.06 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.921 -179.556 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . 0.43 ' N ' HG23 ' A' ' 56' ' ' ILE . . . -54.74 -71.47 0.71 Allowed Glycine 0 CA--C 1.522 0.515 0 N-CA-C 111.205 -0.758 . . . . 0.0 111.205 -178.197 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.578 ' N ' ' O ' ' A' ' 53' ' ' ALA . 0.1 OUTLIER 64.64 27.21 13.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.678 0.275 . . . . 0.0 110.345 179.749 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -153.76 59.07 0.74 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.908 0.385 . . . . 0.0 110.034 -179.323 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 11.0 mt-30 -44.3 -26.05 0.29 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.525 -179.629 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 49.5 m -70.39 -46.12 64.65 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.896 179.798 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.76 -32.25 73.85 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.327 179.867 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 57.7 t -70.38 -50.63 44.64 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.273 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.689 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 11.2 t -58.08 -43.27 86.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.341 -179.664 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -62.12 -50.87 70.18 Favored 'General case' 0 C--O 1.239 0.501 0 CA-C-O 121.048 0.451 . . . . 0.0 110.79 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 86.6 mt-30 -63.36 -35.42 80.34 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.312 179.72 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 6.7 tp -62.99 -44.67 95.41 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.301 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -61.77 -40.7 96.11 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.796 0.331 . . . . 0.0 110.293 179.878 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 89.3 t -65.73 -54.28 29.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 C-N-CA 120.159 -0.616 . . . . 0.0 110.594 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 91.1 mt -60.9 -39.21 88.44 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.879 0.371 . . . . 0.0 110.059 -179.591 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 77.3 ttt-85 -59.63 -40.91 89.17 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.399 179.744 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 13.4 m120 -56.89 -47.53 80.27 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.338 -179.253 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.519 HD22 ' N ' ' A' ' 73' ' ' LEU . 4.0 mm? -65.89 -41.28 91.74 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.685 179.321 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 110.19 33.54 2.53 Favored Glycine 0 CA--C 1.526 0.749 0 N-CA-C 110.978 -0.849 . . . . 0.0 110.978 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.504 HD22 ' N ' ' A' ' 75' ' ' LEU . 3.8 mm? -91.2 -18.37 24.54 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.781 0.324 . . . . 0.0 110.601 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 31.6 m -136.38 160.13 38.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.159 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 46.5 t -134.54 142.07 41.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.421 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -115.57 140.7 16.42 Favored Glycine 0 CA--C 1.525 0.66 0 N-CA-C 110.496 -1.042 . . . . 0.0 110.496 179.299 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 . . . . . 0 N--CA 1.466 0.335 0 CA-C-O 120.837 0.351 . . . . 0.0 110.385 -179.915 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 54.5 t . . . . . 0 N--CA 1.464 0.231 0 N-CA-C 110.222 -0.288 . . . . 0.0 110.222 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 65.4 m-85 -110.72 133.22 53.53 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.325 179.787 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 26.0 t -151.14 172.13 16.27 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.143 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 60.3 mt -69.61 147.67 50.38 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.629 -179.728 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 6.9 t80 -54.54 -47.66 72.91 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.36 -179.668 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 45.6 t0 -147.03 165.29 30.34 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.869 0.366 . . . . 0.0 110.601 -179.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . 0.556 ' O ' ' HB3' ' A' ' 95' ' ' ALA . 80.8 p -75.1 -22.32 58.33 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.578 -179.931 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 25.6 m170 -40.22 -66.13 0.34 Allowed 'General case' 0 C--O 1.236 0.368 0 CA-C-O 121.101 0.477 . . . . 0.0 110.637 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 22.7 m -50.48 -35.35 12.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.101 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.556 ' HB3' ' O ' ' A' ' 92' ' ' THR . . . -64.55 -41.06 96.56 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.542 179.607 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 96.5 mm-40 -61.27 -45.79 93.05 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.925 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 15.2 tp -60.09 -43.53 95.45 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.302 -0.559 . . . . 0.0 110.102 -179.632 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 52.3 tp -64.21 -38.06 89.7 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.077 -179.77 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.9 m-20 -60.99 -43.5 98.74 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.233 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -67.02 -43.83 81.81 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.352 179.334 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.07 -44.04 91.81 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.183 -0.462 . . . . 0.0 109.78 179.216 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 4.8 mm -63.85 -43.71 97.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 121.213 0.53 . . . . 0.0 110.588 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -60.73 -44.4 96.71 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.082 -179.886 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' HIS . . . . . 0.623 ' ND1' ' N ' ' A' ' 105' ' ' SER . 0.0 OUTLIER -67.72 -34.65 77.28 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.103 179.523 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.623 ' N ' ' ND1' ' A' ' 104' ' ' HIS . 5.6 t -59.15 -50.59 73.46 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.383 -178.141 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 13.2 tm-20 -75.35 -52.89 9.72 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.93 179.265 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 4.2 m-70 . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.123 -178.733 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 91.0 m-20 . . . . . 0 C--O 1.237 0.441 0 CA-C-O 121.281 0.563 . . . . 0.0 110.979 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 5.6 t -57.67 -44.65 85.9 Favored 'General case' 0 C--O 1.24 0.555 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.444 -179.326 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 9.5 mm100 -66.44 -42.17 88.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.35 179.797 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 138' ' ' ALA . . . . . 0.546 ' O ' HG23 ' B' ' 142' ' ' VAL . . . -51.7 -47.51 63.9 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.457 -0.572 . . . . 0.0 109.457 -179.049 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -61.53 -53.45 56.17 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 120.329 -0.548 . . . . 0.0 110.196 178.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -52.66 -47.36 67.16 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 120.74 -0.384 . . . . 0.0 111.088 179.767 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 88.6 mm-40 -56.61 -49.46 74.89 Favored 'General case' 0 C--O 1.241 0.608 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.647 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 142' ' ' VAL . . . . . 0.546 HG23 ' O ' ' B' ' 138' ' ' ALA . 80.3 t -60.94 -38.31 79.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.891 179.617 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 143' ' ' ALA . . . . . 0.697 ' HB2' HD12 ' A' ' 36' ' ' LEU . . . -64.36 -42.02 96.43 Favored 'General case' 0 C--O 1.22 -0.481 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.485 178.819 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 75.3 m -56.3 -50.05 72.54 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.914 0.388 . . . . 0.0 110.956 -178.736 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 145' ' ' THR . . . . . 0.42 ' O ' HD13 ' B' ' 149' ' ' LEU . 1.4 t -65.81 -48.96 69.94 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.925 179.82 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 146' ' ' LEU . . . . . 0.438 HD23 ' HA ' ' B' ' 146' ' ' LEU . 68.9 mt -61.44 -26.4 67.85 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.858 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 147' ' ' GLN . . . . . 0.667 ' NE2' ' NE2' ' A' ' 28' ' ' GLN . 31.0 tp60 -73.25 -59.08 2.87 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.341 179.178 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -56.24 -54.0 50.47 Favored 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 120.761 -0.375 . . . . 0.0 110.728 -179.319 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.512 ' O ' ' O ' ' B' ' 150' ' ' ALA . 7.4 mp -46.47 -34.75 5.01 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.266 -179.105 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 150' ' ' ALA . . . . . 0.512 ' O ' ' O ' ' B' ' 149' ' ' LEU . . . -57.6 -130.81 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.548 0 O-C-N 123.641 0.588 . . . . 0.0 109.955 179.381 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 151' ' ' THR . . . . . 0.49 ' O ' ' O ' ' B' ' 150' ' ' ALA . 0.7 OUTLIER 52.85 111.81 0.01 OUTLIER Pre-proline 0 CA--C 1.542 0.66 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.393 179.72 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -49.69 -57.02 2.58 Favored 'Trans proline' 0 N--CA 1.496 1.624 0 C-N-CA 122.149 1.899 . . . . 0.0 113.425 -179.381 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 61.1 p -53.36 -46.34 69.54 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.165 -178.135 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 10.6 mpt_? -61.28 -42.41 98.6 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.51 -179.623 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 155' ' ' LEU . . . . . 0.682 HD12 ' HB2' ' A' ' 24' ' ' ALA . 4.9 mt -61.58 -51.8 67.05 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 120.375 -0.53 . . . . 0.0 110.749 -179.178 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 11.4 tpt -53.91 -48.83 69.76 Favored 'General case' 0 C--O 1.24 0.6 0 C-N-CA 120.263 -0.575 . . . . 0.0 110.351 -179.664 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 157' ' ' ILE . . . . . 0.419 ' O ' ' HG2' ' B' ' 160' ' ' GLN . 96.6 mt -63.38 -45.41 98.15 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 CA-C-O 121.67 0.748 . . . . 0.0 110.395 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 52.4 mt -62.33 -38.29 88.9 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.574 179.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 11.7 m -59.42 -42.7 92.44 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.977 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 160' ' ' GLN . . . . . 0.853 ' NE2' HD11 ' B' ' 171' ' ' LEU . 0.0 OUTLIER -57.14 -44.33 83.29 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 120.384 -0.526 . . . . 0.0 110.316 179.875 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 161' ' ' LEU . . . . . 0.596 ' N ' ' HG2' ' B' ' 160' ' ' GLN . 13.9 mt -64.55 -37.25 86.89 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.254 -179.335 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 162' ' ' ARG . . . . . . . . . . . . . 73.5 ttp85 -52.19 -38.2 57.11 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.323 -179.363 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 49.8 t-20 -56.32 -40.76 74.9 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.86 0.362 . . . . 0.0 110.212 -179.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . 153.18 178.07 27.37 Favored Glycine 0 CA--C 1.524 0.612 0 N-CA-C 111.17 -0.772 . . . . 0.0 111.17 179.09 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_exo -69.08 143.83 55.52 Favored 'Trans proline' 0 C--N 1.312 -1.382 0 C-N-CA 122.764 2.309 . . . . 0.0 112.103 -179.723 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 166' ' ' LEU . . . . . 0.568 ' O ' HD12 ' B' ' 166' ' ' LEU . 0.3 OUTLIER -165.69 159.48 13.42 Favored Pre-proline 0 C--N 1.326 -0.427 0 C-N-CA 120.336 -0.546 . . . . 0.0 110.714 179.682 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -63.81 142.53 83.04 Favored 'Trans proline' 0 N--CA 1.495 1.598 0 C-N-CA 122.413 2.075 . . . . 0.0 112.367 178.782 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . 48.0 t -62.69 -42.85 97.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.398 179.437 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 169' ' ' THR . . . . . 0.46 HG23 HE22 ' B' ' 179' ' ' GLN . 17.0 m -55.83 -69.18 0.15 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.817 -179.608 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 47.6 t0 -52.39 -40.42 62.05 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-O 121.362 0.601 . . . . 0.0 109.818 -179.18 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 171' ' ' LEU . . . . . 0.853 HD11 ' NE2' ' B' ' 160' ' ' GLN . 2.9 tm? -59.59 -47.95 83.55 Favored 'General case' 0 N--CA 1.439 -0.975 0 C-N-CA 119.707 -0.797 . . . . 0.0 110.413 -179.589 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 172' ' ' ALA . . . . . 0.553 ' O ' ' N ' ' B' ' 177' ' ' MET . . . -56.36 -39.69 73.31 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.345 0.593 . . . . 0.0 110.252 -179.444 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -64.3 -28.45 69.72 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.575 179.312 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 174' ' ' ALA . . . . . 0.419 ' HB3' ' O ' ' B' ' 171' ' ' LEU . . . -63.64 -41.0 98.28 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.093 -179.921 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 6.0 tt -168.72 -33.5 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.895 -179.392 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . -54.78 -63.87 4.85 Favored Glycine 0 CA--C 1.523 0.552 0 C-N-CA 120.812 -0.709 . . . . 0.0 111.472 -178.156 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 177' ' ' MET . . . . . 0.553 ' N ' ' O ' ' B' ' 172' ' ' ALA . 3.4 mmt 56.07 29.22 14.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.716 0.293 . . . . 0.0 110.269 -179.917 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 86.4 mt-10 -155.35 60.87 0.63 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.36 -179.575 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 179' ' ' GLN . . . . . 0.46 HE22 HG23 ' B' ' 169' ' ' THR . 18.0 mt-30 -47.1 -28.19 1.66 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.504 -179.583 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 48.0 m -69.92 -45.4 67.62 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.769 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -65.02 -32.21 73.83 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.437 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 63.5 t -70.22 -50.5 46.44 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.266 0 C-N-CA 120.873 -0.331 . . . . 0.0 110.755 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 13.5 t -58.7 -41.81 87.13 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.217 -179.856 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -62.6 -50.97 69.16 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-O 121.089 0.471 . . . . 0.0 110.779 -179.963 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -64.12 -34.12 77.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.145 179.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 7.2 tp -63.47 -45.15 92.12 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.172 179.906 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -61.81 -41.74 98.14 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.752 0.31 . . . . 0.0 110.262 -179.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 83.9 t -64.07 -54.67 28.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 C-N-CA 120.107 -0.637 . . . . 0.0 110.474 -179.834 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 93.0 mt -61.07 -39.07 88.5 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 -179.445 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 73.0 ttt-85 -58.72 -40.43 83.73 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.482 179.746 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 17.6 m120 -58.17 -46.43 85.74 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.674 -0.41 . . . . 0.0 110.442 -179.468 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 192' ' ' LEU . . . . . 0.519 ' N ' HD22 ' B' ' 192' ' ' LEU . 3.9 mm? -66.49 -41.01 89.59 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.631 179.4 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 108.74 34.57 2.59 Favored Glycine 0 CA--C 1.524 0.608 0 N-CA-C 111.015 -0.834 . . . . 0.0 111.015 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 194' ' ' LEU . . . . . 0.505 HD22 ' N ' ' B' ' 194' ' ' LEU . 3.9 mm? -92.31 -17.6 24.5 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.82 0.343 . . . . 0.0 110.519 179.942 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 27.5 m -137.29 160.49 35.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.232 179.864 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 196' ' ' VAL . . . . . . . . . . . . . 50.4 t -135.49 143.59 36.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.284 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 197' ' ' GLY . . . . . . . . . . . . . . . -117.09 141.15 16.45 Favored Glycine 0 CA--C 1.523 0.575 0 N-CA-C 110.643 -0.983 . . . . 0.0 110.643 179.605 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 . . . . . 0 N--CA 1.467 0.389 0 CA-C-O 120.864 0.364 . . . . 0.0 110.466 179.943 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 58.5 t . . . . . 0 N--CA 1.464 0.25 0 N-CA-C 110.189 -0.3 . . . . 0.0 110.189 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 -111.85 133.84 53.8 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.429 179.691 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 45.5 t -151.78 172.33 16.31 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.211 179.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . 56.8 mt -69.11 147.72 51.02 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.56 -179.729 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 7.2 t80 -54.56 -46.29 73.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.257 -179.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 210' ' ' ASP . . . . . 0.509 ' OD2' ' CD2' ' B' ' 212' ' ' HIS . 45.2 t0 -147.91 170.58 17.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.557 -179.665 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 211' ' ' THR . . . . . 0.492 ' O ' ' HB3' ' B' ' 214' ' ' ALA . 81.6 p -80.14 -19.36 47.41 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.63 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 212' ' ' HIS . . . . . 0.509 ' CD2' ' OD2' ' B' ' 210' ' ' ASP . 22.3 m170 -43.38 -65.84 0.45 Allowed 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.159 0.504 . . . . 0.0 110.738 -179.851 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 213' ' ' VAL . . . . . 0.427 HG23 ' N ' ' B' ' 214' ' ' ALA . 29.4 m -50.41 -36.8 13.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.214 -179.667 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 214' ' ' ALA . . . . . 0.492 ' HB3' ' O ' ' B' ' 211' ' ' THR . . . -63.16 -40.28 97.1 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.501 179.673 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 97.4 mm-40 -62.36 -45.89 91.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.987 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 216' ' ' LEU . . . . . . . . . . . . . 15.3 tp -59.62 -43.55 93.76 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.227 -0.589 . . . . 0.0 110.02 -179.551 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 56.1 tp -63.89 -39.58 94.5 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.046 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 99.9 m-20 -59.41 -44.04 92.9 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.352 -179.599 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 219' ' ' GLU . . . . . . . . . . . . . 67.7 mm-40 -66.26 -44.02 84.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.457 179.105 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -59.32 -44.17 92.61 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 179.284 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 4.7 mm -63.36 -44.01 98.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 121.158 0.504 . . . . 0.0 110.457 -179.886 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 222' ' ' TYR . . . . . 0.441 ' O ' ' CG ' ' B' ' 226' ' ' HIS . 3.8 m-85 -61.2 -42.83 99.29 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.111 -179.801 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 223' ' ' HIS . . . . . 0.629 ' ND1' ' N ' ' B' ' 224' ' ' SER . 0.0 OUTLIER -68.76 -36.37 78.25 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.061 0.458 . . . . 0.0 110.228 179.431 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 224' ' ' SER . . . . . 0.629 ' N ' ' ND1' ' B' ' 223' ' ' HIS . 41.6 t -58.84 -49.09 79.04 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.122 -178.097 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 9.6 tm-20 -75.58 -54.42 7.02 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.955 179.135 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 226' ' ' HIS . . . . . 0.441 ' CG ' ' O ' ' B' ' 222' ' ' TYR . 4.7 m-70 . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.21 -178.695 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . 0.506 ' O ' ' N ' ' A' ' 19' ' ' ALA . 19.1 t70 . . . . . 0 N--CA 1.462 0.148 0 CA-C-O 120.593 0.235 . . . . 0.0 110.82 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 42.2 t -38.72 -42.33 0.79 Allowed 'General case' 0 C--O 1.241 0.657 0 CA-C-O 121.375 0.607 . . . . 0.0 110.381 -179.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 54.6 mt-30 -65.32 -43.3 91.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.164 179.022 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.506 ' N ' ' O ' ' A' ' 16' ' ' ASP . . . -62.61 -31.44 72.28 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.108 179.639 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.88 -53.27 53.21 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 179.683 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.37 -46.14 83.69 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.489 -0.484 . . . . 0.0 110.81 179.365 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 59.3 tt0 -56.1 -51.11 69.07 Favored 'General case' 0 C--O 1.242 0.668 0 CA-C-O 121.544 0.687 . . . . 0.0 110.38 -179.778 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 75.2 t -62.41 -43.31 98.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.753 179.558 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.461 ' HB2' HD12 ' B' ' 155' ' ' LEU . . . -49.39 -50.22 41.22 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.299 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 58.1 m -59.18 -42.34 90.59 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 91.2 m -63.31 -50.92 68.13 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 120.363 -0.535 . . . . 0.0 111.105 179.869 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 96.0 mt -68.35 -22.16 64.69 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.56 -179.739 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.502 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 49.5 tt0 -74.69 -58.0 3.57 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.281 179.559 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.6 -54.14 50.38 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.722 -0.391 . . . . 0.0 110.283 -179.731 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.496 ' O ' ' O ' ' A' ' 31' ' ' ALA . 77.1 mt -44.91 -33.14 1.86 Allowed 'General case' 0 CA--C 1.513 -0.481 0 C-N-CA 121.024 -0.27 . . . . 0.0 110.458 -179.198 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.502 ' HB3' ' O ' ' A' ' 28' ' ' GLN . . . -57.61 -128.27 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.12 179.233 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.47 ' HG1' ' HB3' ' A' ' 35' ' ' ARG . 0.6 OUTLIER 54.26 107.18 0.03 OUTLIER Pre-proline 0 CA--C 1.54 0.579 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.571 -179.959 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -49.27 -58.68 1.6 Allowed 'Trans proline' 0 N--CA 1.496 1.663 0 C-N-CA 122.165 1.91 . . . . 0.0 113.429 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 78.4 p -55.54 -43.33 75.69 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.802 -179.149 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.47 ' HB3' ' HG1' ' A' ' 32' ' ' THR . 44.4 ttm180 -61.06 -44.29 97.61 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 120.817 -0.353 . . . . 0.0 110.663 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.468 HD12 ' HB2' ' B' ' 143' ' ' ALA . 7.1 mt -61.03 -45.74 93.57 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.467 -0.493 . . . . 0.0 110.908 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.614 ' SD ' HD11 ' A' ' 56' ' ' ILE . 0.0 OUTLIER -55.21 -46.79 75.91 Favored 'General case' 0 C--N 1.319 -0.741 0 C-N-CA 120.15 -0.62 . . . . 0.0 110.163 -179.886 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.484 ' CD1' ' OE1' ' A' ' 66' ' ' GLN . 65.0 mt -63.72 -45.34 97.59 Favored 'Isoleucine or valine' 0 C--O 1.239 0.532 0 CA-C-O 121.601 0.715 . . . . 0.0 110.734 -179.824 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -63.28 -40.95 98.83 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.765 179.827 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.437 ' OG1' ' O ' ' A' ' 37' ' ' MET . 15.3 p -61.42 -37.34 83.15 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.944 179.974 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -62.1 -47.46 84.53 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.516 -0.474 . . . . 0.0 109.855 179.335 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 29.3 mt -64.54 -35.39 80.8 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.762 179.525 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 62.5 ttp180 -55.15 -31.94 61.73 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.57 -179.521 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 98.4 m-20 -61.15 -41.03 96.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.507 -179.647 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.42 ' O ' ' CD2' ' A' ' 47' ' ' LEU . . . 155.83 -160.38 29.96 Favored Glycine 0 CA--C 1.528 0.847 0 N-CA-C 110.951 -0.86 . . . . 0.0 110.951 180.0 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_exo -61.67 144.08 97.07 Favored 'Trans proline' 0 C--N 1.309 -1.528 0 C-N-CA 122.96 2.44 . . . . 0.0 111.976 179.499 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.43 HD12 ' O ' ' A' ' 47' ' ' LEU . 0.3 OUTLIER 176.95 94.21 0.12 Allowed Pre-proline 0 CA--C 1.538 0.507 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.353 179.706 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo -48.32 177.88 0.01 OUTLIER 'Trans proline' 0 C--N 1.297 -2.155 0 C-N-CA 122.282 1.988 . . . . 0.0 112.485 -179.737 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.521 HG23 ' N ' ' A' ' 50' ' ' THR . 4.7 m -59.97 -42.39 89.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 121.51 0.671 . . . . 0.0 110.367 -179.759 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.521 ' N ' HG23 ' A' ' 49' ' ' VAL . 11.1 m -59.87 -41.4 91.43 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.007 -0.997 . . . . 0.0 110.537 179.641 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -73.95 -46.58 43.21 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.702 179.57 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.682 HD23 ' O ' ' A' ' 52' ' ' LEU . 5.2 tt -61.42 -45.52 93.97 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.586 -179.281 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.86 -46.33 78.85 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.666 -0.414 . . . . 0.0 111.281 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -55.61 -35.81 66.27 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.138 -179.429 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . 0.484 ' O ' HG23 ' A' ' 56' ' ' ILE . . . -50.96 -59.59 3.98 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.516 -0.473 . . . . 0.0 110.708 -179.291 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.614 HD11 ' SD ' ' A' ' 37' ' ' MET . 2.2 pp -158.84 -18.17 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.605 -179.704 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -58.84 -64.78 3.98 Favored Glycine 0 CA--C 1.523 0.552 0 N-CA-C 111.209 -0.756 . . . . 0.0 111.209 -179.171 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.488 ' O ' ' SD ' ' A' ' 58' ' ' MET . 0.0 OUTLIER 67.73 40.45 2.45 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.713 0.292 . . . . 0.0 110.328 179.996 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.477 ' O ' ' N ' ' A' ' 61' ' ' SER . 72.1 tt0 -169.01 60.86 0.05 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 13.1 mt-30 -41.45 -23.12 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.766 -179.434 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.477 ' N ' ' O ' ' A' ' 59' ' ' GLU . 69.3 m -68.7 -43.34 76.24 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.917 179.923 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.461 ' H ' ' HG2' ' A' ' 59' ' ' GLU . . . -68.12 -30.5 69.66 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.628 -179.888 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 59.4 t -72.18 -51.59 29.27 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.294 0 C-N-CA 120.882 -0.327 . . . . 0.0 110.845 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 40.8 t -59.8 -42.28 93.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.33 -179.738 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -62.82 -51.21 67.92 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-O 120.986 0.422 . . . . 0.0 110.995 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . 0.484 ' OE1' ' CD1' ' A' ' 38' ' ' ILE . 73.5 mt-30 -63.66 -36.87 85.27 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.055 0.455 . . . . 0.0 110.471 179.968 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 5.9 tt -62.1 -43.75 98.15 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.479 -179.76 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -62.97 -41.79 99.64 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.862 0.363 . . . . 0.0 110.434 179.459 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 75.5 t -61.52 -54.18 38.42 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.206 0 C-N-CA 119.88 -0.728 . . . . 0.0 110.134 -179.726 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 94.9 mt -62.31 -37.31 85.09 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.175 0.512 . . . . 0.0 109.851 -179.561 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 7.4 tmm_? -57.34 -38.82 74.71 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.454 -179.842 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 99.0 m-20 -62.07 -41.09 97.81 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.421 -179.823 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.447 HD23 ' N ' ' A' ' 73' ' ' LEU . 7.2 mt -66.02 -39.11 89.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.242 -179.488 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 102.79 31.72 5.03 Favored Glycine 0 CA--C 1.525 0.678 0 N-CA-C 111.011 -0.836 . . . . 0.0 111.011 -179.839 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 83.9 mt -95.04 -15.7 23.26 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 120.751 0.31 . . . . 0.0 110.701 179.774 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 33.4 m -136.88 160.7 36.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.088 179.855 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 40.3 t -137.71 150.42 25.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.345 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -124.74 145.89 15.94 Favored Glycine 0 CA--C 1.52 0.397 0 N-CA-C 110.237 -1.145 . . . . 0.0 110.237 179.437 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 . . . . . 0 C--O 1.236 0.363 0 CA-C-O 120.827 0.346 . . . . 0.0 110.469 -179.996 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 78.8 t . . . . . 0 C--O 1.231 0.124 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 -104.86 129.94 53.09 Favored 'General case' 0 CA--C 1.52 -0.181 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 50.7 m -149.24 171.38 16.58 Favored 'General case' 0 N--CA 1.462 0.151 0 N-CA-C 110.049 -0.352 . . . . 0.0 110.049 -179.685 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 17.7 mt -67.98 148.96 50.33 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.428 -179.304 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -52.01 -44.92 64.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.2 -179.582 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.532 ' OD2' ' CD2' ' A' ' 93' ' ' HIS . 13.2 t70 -147.44 -177.55 5.76 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.327 -179.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . 0.451 ' H ' ' CG ' ' A' ' 91' ' ' ASP . 6.6 p -90.86 -13.46 33.65 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.576 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . 0.532 ' CD2' ' OD2' ' A' ' 91' ' ' ASP . 91.2 m-70 -48.74 -65.08 0.63 Allowed 'General case' 0 C--O 1.235 0.323 0 CA-C-O 120.809 0.337 . . . . 0.0 110.712 179.879 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.46 HG23 ' N ' ' A' ' 95' ' ' ALA . 27.2 m -50.74 -38.79 17.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.062 -179.684 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.46 ' N ' HG23 ' A' ' 94' ' ' VAL . . . -61.66 -41.07 97.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.338 179.778 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 64.6 tp60 -61.92 -45.72 92.46 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.866 -179.615 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 13.0 tp -59.4 -42.32 91.47 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.584 -0.446 . . . . 0.0 110.133 -179.257 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 92.7 mt -63.33 -40.23 96.73 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.149 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . 0.435 ' OD1' ' CE1' ' A' ' 103' ' ' TYR . 65.7 t0 -60.22 -42.58 95.49 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.201 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -67.09 -50.22 62.33 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.491 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -56.19 -43.28 78.3 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 179.621 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 4.6 mm -62.48 -43.69 98.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 C-N-CA 120.384 -0.526 . . . . 0.0 110.439 -179.735 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' TYR . . . . . 0.435 ' CE1' ' OD1' ' A' ' 99' ' ' ASP . 3.3 m-85 -58.87 -41.31 86.77 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.868 -179.942 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 68.7 t60 -65.8 -38.78 89.89 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.619 179.501 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 43.2 t -58.96 -46.32 88.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.24 -179.638 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -75.01 -58.05 3.52 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.008 0.432 . . . . 0.0 110.954 179.228 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 84.7 t60 . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 115.725 -0.671 . . . . 0.0 109.735 -179.341 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 135' ' ' ASP . . . . . 0.498 ' O ' ' N ' ' B' ' 138' ' ' ALA . 20.3 t70 . . . . . 0 N--CA 1.46 0.07 0 CA-C-O 120.698 0.285 . . . . 0.0 110.758 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 25.8 t -38.47 -42.05 0.71 Allowed 'General case' 0 C--O 1.242 0.659 0 CA-C-O 121.218 0.533 . . . . 0.0 110.484 -179.722 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 74.9 mt-30 -65.45 -43.59 89.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.041 179.146 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 138' ' ' ALA . . . . . 0.498 ' N ' ' O ' ' B' ' 135' ' ' ASP . . . -62.97 -31.34 72.43 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.211 179.729 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -64.12 -53.11 54.75 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 120.957 0.408 . . . . 0.0 109.901 179.677 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -57.63 -46.78 83.7 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.737 179.424 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -55.9 -50.02 71.83 Favored 'General case' 0 C--O 1.242 0.67 0 CA-C-O 121.563 0.697 . . . . 0.0 110.171 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 142' ' ' VAL . . . . . 0.407 HG23 ' O ' ' B' ' 138' ' ' ALA . 77.7 t -62.61 -43.56 98.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.688 179.611 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 143' ' ' ALA . . . . . 0.468 ' HB2' HD12 ' A' ' 36' ' ' LEU . . . -49.63 -49.27 47.73 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.418 179.888 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 55.2 m -59.17 -43.0 92.12 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.33 -0.395 . . . . 0.0 109.977 179.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 89.0 m -63.27 -50.39 70.33 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 120.386 -0.526 . . . . 0.0 110.995 179.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 96.0 mt -68.82 -22.78 64.22 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.799 -179.785 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 147' ' ' GLN . . . . . 0.485 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 49.9 tt0 -74.62 -57.63 3.8 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.402 179.483 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -58.63 -54.13 50.52 Favored 'General case' 0 CA--C 1.519 -0.227 0 C-N-CA 120.57 -0.452 . . . . 0.0 110.388 -179.579 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.501 ' O ' ' O ' ' B' ' 150' ' ' ALA . 77.5 mt -45.26 -33.53 2.42 Favored 'General case' 0 CA--C 1.513 -0.465 0 C-N-CA 121.021 -0.272 . . . . 0.0 110.441 -178.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 150' ' ' ALA . . . . . 0.501 ' O ' ' O ' ' B' ' 149' ' ' LEU . . . -57.1 -128.35 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.238 0.542 . . . . 0.0 110.309 179.363 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 151' ' ' THR . . . . . 0.495 ' HG1' ' C ' ' B' ' 150' ' ' ALA . 0.6 OUTLIER 54.3 108.61 0.02 OUTLIER Pre-proline 0 CA--C 1.541 0.623 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.558 -179.722 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -49.73 -59.18 1.32 Allowed 'Trans proline' 0 N--CA 1.494 1.555 0 C-N-CA 122.197 1.931 . . . . 0.0 113.317 179.73 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 84.3 p -54.92 -43.96 73.78 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.812 -179.101 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 44.2 ttm180 -60.79 -44.43 96.84 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.574 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 155' ' ' LEU . . . . . 0.461 HD12 ' HB2' ' A' ' 24' ' ' ALA . 7.2 mt -60.92 -46.16 91.78 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.365 -0.534 . . . . 0.0 110.694 -179.926 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 156' ' ' MET . . . . . 0.634 ' SD ' HD11 ' B' ' 175' ' ' ILE . 0.0 OUTLIER -54.58 -47.22 73.56 Favored 'General case' 0 C--N 1.318 -0.764 0 C-N-CA 120.116 -0.634 . . . . 0.0 110.131 -179.91 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 157' ' ' ILE . . . . . 0.452 ' CD1' ' OE1' ' B' ' 185' ' ' GLN . 67.4 mt -63.61 -45.78 96.64 Favored 'Isoleucine or valine' 0 C--O 1.239 0.544 0 CA-C-O 121.483 0.658 . . . . 0.0 110.808 -179.757 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -63.01 -40.45 97.81 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.866 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 159' ' ' THR . . . . . 0.443 HG23 ' O ' ' B' ' 155' ' ' LEU . 18.1 p -61.22 -38.17 85.66 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 116.088 -0.505 . . . . 0.0 109.938 -180.0 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 14.4 mm100 -61.52 -47.29 86.27 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.549 -0.46 . . . . 0.0 109.923 179.395 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 161' ' ' LEU . . . . . . . . . . . . . 29.4 mt -64.71 -34.79 79.15 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.837 179.622 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 162' ' ' ARG . . . . . . . . . . . . . 62.6 ttp180 -56.3 -30.79 62.97 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.674 -179.46 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 98.1 m-20 -61.74 -41.1 97.21 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.462 -179.631 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 164' ' ' GLY . . . . . 0.427 ' O ' ' CD2' ' B' ' 166' ' ' LEU . . . 156.49 -160.44 30.22 Favored Glycine 0 CA--C 1.526 0.755 0 N-CA-C 110.887 -0.885 . . . . 0.0 110.887 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_exo -62.13 143.25 94.37 Favored 'Trans proline' 0 C--N 1.308 -1.556 0 C-N-CA 123.016 2.477 . . . . 0.0 112.024 179.434 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 166' ' ' LEU . . . . . 0.427 ' CD2' ' O ' ' B' ' 164' ' ' GLY . 0.3 OUTLIER 177.96 95.13 0.14 Allowed Pre-proline 0 CA--C 1.538 0.499 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.408 179.682 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_exo -48.51 177.94 0.02 OUTLIER 'Trans proline' 0 C--N 1.299 -2.075 0 C-N-CA 122.353 2.035 . . . . 0.0 112.377 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 168' ' ' VAL . . . . . 0.514 HG23 ' N ' ' B' ' 169' ' ' THR . 4.2 m -59.87 -42.36 88.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 121.589 0.709 . . . . 0.0 110.388 -179.728 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 169' ' ' THR . . . . . 0.514 ' N ' HG23 ' B' ' 168' ' ' VAL . 9.8 m -59.48 -40.84 88.29 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.454 179.902 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -74.11 -46.33 43.41 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.759 179.517 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 171' ' ' LEU . . . . . 0.681 HD23 ' O ' ' B' ' 171' ' ' LEU . 4.8 tt -61.64 -44.2 97.43 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.348 -178.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 172' ' ' ALA . . . . . . . . . . . . . . . -67.35 -46.94 71.91 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.131 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 82.3 tt0 -54.93 -36.38 65.2 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.219 -179.479 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 174' ' ' ALA . . . . . 0.506 ' O ' HG23 ' B' ' 175' ' ' ILE . . . -51.15 -59.6 4.01 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.463 -0.495 . . . . 0.0 110.821 -179.19 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 175' ' ' ILE . . . . . 0.634 HD11 ' SD ' ' B' ' 156' ' ' MET . 2.2 pp -159.08 -17.4 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.567 -179.493 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . -60.12 -64.17 4.4 Favored Glycine 0 CA--C 1.524 0.595 0 N-CA-C 111.112 -0.795 . . . . 0.0 111.112 -179.347 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 177' ' ' MET . . . . . 0.495 ' O ' ' SD ' ' B' ' 177' ' ' MET . 0.0 OUTLIER 66.71 40.78 3.16 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.707 0.289 . . . . 0.0 110.268 179.927 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 178' ' ' GLU . . . . . 0.49 ' O ' ' N ' ' B' ' 180' ' ' SER . 71.9 tt0 -168.33 60.41 0.06 Allowed 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 179.919 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 13.2 mt-30 -41.27 -22.82 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.766 -179.378 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 180' ' ' SER . . . . . 0.49 ' N ' ' O ' ' B' ' 178' ' ' GLU . 49.1 m -68.84 -43.85 74.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.99 179.831 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 181' ' ' ALA . . . . . 0.485 ' H ' ' HG2' ' B' ' 178' ' ' GLU . . . -68.02 -30.16 69.34 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.591 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 57.9 t -72.03 -51.66 29.49 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 C-N-CA 120.811 -0.356 . . . . 0.0 110.893 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 6.5 t -59.54 -42.61 92.73 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.255 -179.763 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -62.85 -50.69 69.95 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 120.931 0.396 . . . . 0.0 110.979 -179.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 185' ' ' GLN . . . . . 0.452 ' OE1' ' CD1' ' B' ' 157' ' ' ILE . 74.2 mt-30 -63.62 -36.72 84.75 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.533 179.915 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 5.8 tt -62.79 -44.07 97.14 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.662 -179.818 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -62.51 -41.78 99.06 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.413 179.607 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 76.8 t -61.66 -54.26 37.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 C-N-CA 119.881 -0.728 . . . . 0.0 110.174 -179.765 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 86.6 mt -62.26 -37.49 85.65 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.233 0.54 . . . . 0.0 109.954 -179.517 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 7.3 tmm_? -56.93 -40.07 75.67 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.454 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -61.33 -41.28 96.77 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.881 0.372 . . . . 0.0 110.325 -179.512 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 192' ' ' LEU . . . . . 0.463 ' N ' HD23 ' B' ' 192' ' ' LEU . 7.3 mt -65.53 -38.89 90.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.398 -179.508 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 102.46 30.26 5.67 Favored Glycine 0 CA--C 1.524 0.633 0 N-CA-C 110.857 -0.897 . . . . 0.0 110.857 -179.844 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 94.6 mt -93.66 -16.37 24.37 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.85 0.357 . . . . 0.0 110.689 179.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 35.7 m -136.53 160.47 37.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.323 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 196' ' ' VAL . . . . . . . . . . . . . 42.8 t -138.42 152.38 25.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.159 179.783 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 197' ' ' GLY . . . . . . . . . . . . . . . -127.44 147.64 17.15 Favored Glycine 0 CA--C 1.523 0.565 0 N-CA-C 110.448 -1.061 . . . . 0.0 110.448 179.685 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 . . . . . 0 N--CA 1.466 0.333 0 CA-C-O 120.897 0.38 . . . . 0.0 110.524 179.937 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 70.8 t . . . . . 0 N--CA 1.461 0.103 0 N-CA-C 109.959 -0.385 . . . . 0.0 109.959 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 -104.71 129.45 52.91 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 45.3 m -148.82 171.01 16.96 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 110.019 -0.363 . . . . 0.0 110.019 -179.627 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . 18.6 mt -68.41 149.78 48.93 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.454 -179.356 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 9.2 t80 -52.25 -46.44 65.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.316 -179.457 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 210' ' ' ASP . . . . . 0.523 ' OD2' ' CD2' ' B' ' 212' ' ' HIS . 19.0 t70 -146.17 -178.71 6.28 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.791 0.329 . . . . 0.0 110.295 -179.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 211' ' ' THR . . . . . 0.51 ' H ' ' CG ' ' B' ' 210' ' ' ASP . 30.7 p -88.5 -16.47 32.6 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.535 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 212' ' ' HIS . . . . . 0.523 ' CD2' ' OD2' ' B' ' 210' ' ' ASP . 84.2 m-70 -46.47 -65.44 0.55 Allowed 'General case' 0 C--O 1.235 0.312 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.868 -179.834 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 213' ' ' VAL . . . . . 0.446 HG23 ' N ' ' B' ' 214' ' ' ALA . 20.3 m -50.38 -38.42 15.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 121.016 0.436 . . . . 0.0 110.139 -179.561 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 214' ' ' ALA . . . . . 0.446 ' N ' HG23 ' B' ' 213' ' ' VAL . . . -62.21 -40.93 97.74 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.215 179.754 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 68.0 tp60 -62.19 -46.05 90.66 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.871 -179.541 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 216' ' ' LEU . . . . . . . . . . . . . 14.5 tp -59.0 -42.97 91.37 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.003 -179.138 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 88.5 mt -62.8 -40.59 97.83 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.206 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 67.1 t0 -59.37 -43.79 92.83 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.333 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 219' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -66.43 -49.8 65.54 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.438 -0.347 . . . . 0.0 110.547 179.541 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -56.3 -43.02 78.5 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.855 -0.424 . . . . 0.0 109.855 179.496 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 4.2 mm -62.68 -43.55 98.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 C-N-CA 120.39 -0.524 . . . . 0.0 110.463 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -59.09 -41.3 87.72 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.797 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 223' ' ' HIS . . . . . . . . . . . . . 58.8 t60 -65.84 -37.93 87.53 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.471 179.504 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 6.7 t -58.92 -46.99 86.62 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.389 -179.747 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -75.39 -56.69 4.46 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 121.005 0.431 . . . . 0.0 110.898 179.309 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 85.7 t60 . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.864 -179.441 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 . . . . . 0 C--O 1.235 0.332 0 CA-C-O 121.097 0.475 . . . . 0.0 110.555 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 98.5 p -58.25 -33.48 69.41 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.459 -179.713 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -67.19 -49.41 64.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.501 179.428 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.486 ' O ' HG23 ' A' ' 23' ' ' VAL . . . -56.81 -36.79 70.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.165 -179.78 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.426 ' HB1' ' HB3' ' B' ' 155' ' ' LEU . . . -66.31 -53.31 37.96 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.407 179.565 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.06 -44.95 94.35 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.952 -179.716 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -58.9 -50.65 73.24 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.255 0.55 . . . . 0.0 110.339 -179.806 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.486 HG23 ' O ' ' A' ' 19' ' ' ALA . 70.9 t -62.1 -44.4 98.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.94 179.562 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.27 -43.13 82.8 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.137 179.836 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 66.2 m -57.56 -43.51 84.56 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 179.793 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 21.4 m -64.22 -49.06 73.46 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.631 -0.428 . . . . 0.0 110.685 179.207 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 85.9 mt -63.42 -22.53 66.94 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.442 -179.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.526 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 57.6 tt0 -75.33 -57.98 3.56 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.654 179.42 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.21 -54.54 44.55 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.932 -179.391 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.549 ' O ' ' O ' ' A' ' 31' ' ' ALA . 3.9 mm? -48.74 -30.4 5.56 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 -178.962 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.549 ' O ' ' O ' ' A' ' 30' ' ' LEU . . . -56.54 -133.95 0.0 OUTLIER 'General case' 0 C--O 1.22 -0.498 0 C-N-CA 120.366 -0.534 . . . . 0.0 110.362 179.102 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.486 ' O ' ' O ' ' A' ' 31' ' ' ALA . 17.7 p 53.85 114.76 0.01 OUTLIER Pre-proline 0 CA--C 1.543 0.679 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.867 -179.807 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_exo -48.76 -44.54 31.1 Favored 'Trans proline' 0 N--CA 1.498 1.754 0 C-N-CA 122.229 1.953 . . . . 0.0 113.026 -179.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 39.5 t -59.92 -45.46 92.49 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.959 -178.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.406 ' HB3' ' HG1' ' A' ' 32' ' ' THR . 15.7 tpp180 -63.4 -36.47 83.82 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.388 -179.954 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.451 ' CD2' ' O ' ' A' ' 30' ' ' LEU . 1.6 mm? -63.15 -54.38 38.66 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.414 -0.514 . . . . 0.0 110.763 -179.181 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.413 ' O ' ' SD ' ' A' ' 37' ' ' MET . 0.0 OUTLIER -57.18 -49.23 76.61 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.008 -0.677 . . . . 0.0 110.639 -179.396 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 36.6 mm -62.62 -42.75 97.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-O 121.193 0.521 . . . . 0.0 110.383 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 42.6 tp -62.38 -43.03 99.77 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.785 -179.911 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.405 ' OG1' ' O ' ' A' ' 37' ' ' MET . 19.7 p -60.71 -35.88 77.43 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.305 -0.407 . . . . 0.0 109.997 -179.446 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -63.46 -45.85 88.91 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.274 -0.571 . . . . 0.0 110.108 178.932 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 98.1 mt -64.94 -42.54 94.55 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.951 179.701 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.532 ' NH1' ' OD1' ' A' ' 99' ' ' ASP . 68.7 ttp85 -52.04 -17.76 1.16 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.428 -179.9 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -75.91 -76.91 0.14 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.908 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -174.45 -143.67 4.51 Favored Glycine 0 CA--C 1.532 1.131 0 C-N-CA 120.539 -0.839 . . . . 0.0 111.217 -179.509 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -50.16 133.08 34.99 Favored 'Trans proline' 0 N--CA 1.493 1.464 0 C-N-CA 122.328 2.019 . . . . 0.0 112.184 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -136.68 66.79 57.53 Favored Pre-proline 0 CA--C 1.536 0.43 0 CA-C-O 121.547 0.689 . . . . 0.0 111.207 -179.941 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -51.61 148.51 20.85 Favored 'Trans proline' 0 C--N 1.299 -2.028 0 C-N-CA 121.852 1.701 . . . . 0.0 111.343 178.185 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 44.4 t -53.32 -51.4 41.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 121.253 0.549 . . . . 0.0 110.574 -178.377 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 48.4 p -62.92 -38.53 91.33 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.529 179.336 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -63.71 -41.39 98.11 Favored 'General case' 0 CA--C 1.514 -0.404 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.933 179.287 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.703 HD13 ' C ' ' A' ' 52' ' ' LEU . 2.8 tm? -61.58 -47.69 84.33 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 119.675 -0.81 . . . . 0.0 110.11 -179.492 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.515 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -52.69 -47.23 67.38 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.006 179.632 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 45.1 tp10 -54.85 -48.09 73.33 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.516 -0.474 . . . . 0.0 110.35 179.751 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -57.31 -54.0 51.71 Favored 'General case' 0 C--O 1.232 0.138 0 C-N-CA 120.493 -0.483 . . . . 0.0 111.012 -179.589 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.413 HD12 HD11 ' A' ' 52' ' ' LEU . 96.6 mt -89.08 -75.02 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.241 179.71 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . 0.515 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 133.02 96.97 0.63 Allowed Glycine 0 CA--C 1.522 0.513 0 N-CA-C 111.391 -0.684 . . . . 0.0 111.391 179.858 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.404 ' HA ' HE21 ' A' ' 60' ' ' GLN . 78.3 mtm 58.32 77.58 0.29 Allowed 'General case' 0 C--O 1.232 0.155 0 C-N-CA 120.974 -0.29 . . . . 0.0 110.878 179.117 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -173.33 32.63 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.25 0.548 . . . . 0.0 110.083 179.733 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.666 ' H ' ' CD ' ' A' ' 60' ' ' GLN . 0.0 OUTLIER -82.72 -25.06 33.27 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.612 -179.162 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.512 ' O ' ' ND1' ' A' ' 65' ' ' HIS . 73.1 m -65.82 -42.94 90.0 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.395 -179.917 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.56 -36.8 76.67 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.506 179.754 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.41 ' O ' HD23 ' A' ' 67' ' ' LEU . 55.1 t -69.78 -52.24 33.39 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.3 0 C-N-CA 120.495 -0.482 . . . . 0.0 110.802 179.759 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 11.7 t -60.44 -44.58 95.67 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.234 -0.587 . . . . 0.0 110.51 179.691 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' HIS . . . . . 0.579 ' CG ' HH21 ' A' ' 68' ' ' ARG . 0.9 OUTLIER -57.03 -47.54 80.67 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.41 -179.844 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 81.6 mt-30 -59.51 -41.53 90.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.86 0.362 . . . . 0.0 110.836 179.723 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.529 HD13 HG21 ' A' ' 76' ' ' VAL . 3.3 mm? -61.31 -44.14 97.71 Favored 'General case' 0 CA--C 1.513 -0.457 0 C-N-CA 120.616 -0.434 . . . . 0.0 110.56 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.579 HH21 ' CG ' ' A' ' 65' ' ' HIS . 88.2 mtm180 -61.61 -40.82 96.2 Favored 'General case' 0 C--N 1.312 -1.035 0 C-N-CA 120.402 -0.519 . . . . 0.0 110.62 179.777 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.529 HG23 ' O ' ' A' ' 65' ' ' HIS . 94.8 t -58.83 -52.31 61.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 -179.463 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 9.9 mp -67.06 -31.46 71.99 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.854 0.359 . . . . 0.0 110.282 179.042 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.669 HH12 ' N ' ' A' ' 78' ' ' GLY . 9.2 tpt180 -54.65 -43.83 72.69 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.881 -179.169 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -60.8 -43.59 97.96 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.329 -0.548 . . . . 0.0 110.38 179.87 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 10.0 mt -64.91 -38.92 92.59 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.024 0.44 . . . . 0.0 110.537 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 99.29 35.91 4.57 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 110.96 -0.856 . . . . 0.0 110.96 -179.722 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 85.0 mt -99.29 -19.03 17.28 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.746 0.307 . . . . 0.0 110.889 179.818 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.529 HG21 HD13 ' A' ' 67' ' ' LEU . 15.8 m -134.55 157.8 41.45 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.247 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.173 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.455 HG12 ' N ' ' A' ' 78' ' ' GLY . 70.8 t -136.8 156.83 35.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.302 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . 0.669 ' N ' HH12 ' A' ' 71' ' ' ARG . . . -133.29 132.74 6.64 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.856 -0.898 . . . . 0.0 110.856 179.344 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 8.8 t70 . . . . . 0 N--CA 1.465 0.278 0 CA-C-O 120.891 0.377 . . . . 0.0 110.467 179.857 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 97.9 t . . . . . 0 CA--C 1.523 -0.086 0 CA-C-O 120.722 0.296 . . . . 0.0 110.414 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 87.0 m-85 -95.52 127.58 41.67 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.38 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 34.5 p -150.15 165.72 32.0 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 116.195 -0.457 . . . . 0.0 109.867 -179.038 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.752 ' N ' HD22 ' A' ' 89' ' ' LEU . 2.5 mm? -67.82 146.52 53.61 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.561 -179.093 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.473 ' C ' ' CD1' ' A' ' 90' ' ' TYR . 16.4 t80 -58.27 -50.03 75.03 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.446 -179.515 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.527 ' OD1' ' N ' ' A' ' 92' ' ' THR . 53.7 t0 -101.0 155.6 17.88 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.473 -179.644 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . 0.527 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 62.8 p -92.99 -24.34 18.39 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 121.104 0.478 . . . . 0.0 110.576 179.503 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -57.47 -47.94 80.52 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.221 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.554 HG13 ' N ' ' A' ' 95' ' ' ALA . 8.0 p -55.05 -44.78 75.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.243 -0.435 . . . . 0.0 109.857 -179.936 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.554 ' N ' HG13 ' A' ' 94' ' ' VAL . . . -56.0 -41.94 75.64 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.039 179.638 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 9.4 tp-100 -61.74 -39.49 91.76 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.071 179.616 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.514 ' CD1' ' HB2' ' B' ' 220' ' ' ALA . 13.5 tp -60.36 -43.51 96.44 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.153 -0.476 . . . . 0.0 109.92 -179.597 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.418 ' O ' HG22 ' A' ' 102' ' ' ILE . 4.1 mm? -64.25 -37.18 86.57 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.302 179.251 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . 0.532 ' OD1' ' NH1' ' A' ' 43' ' ' ARG . 97.2 m-20 -60.65 -39.89 90.0 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.186 0.517 . . . . 0.0 110.378 179.861 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -72.78 -47.24 48.33 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.391 -0.524 . . . . 0.0 110.653 179.4 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . 0.428 ' HB2' ' CD1' ' B' ' 216' ' ' LEU . . . -62.66 -50.94 69.21 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.042 -179.851 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.554 HG23 ' N ' ' A' ' 103' ' ' TYR . 10.7 tp -59.21 -47.13 91.34 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.412 -178.673 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' TYR . . . . . 0.554 ' N ' HG23 ' A' ' 102' ' ' ILE . 79.5 t80 -60.54 -39.55 88.31 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.275 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' HIS . . . . . 0.482 ' CE1' ' OD2' ' B' ' 210' ' ' ASP . 0.9 OUTLIER -61.19 -41.66 97.19 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.728 179.601 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 33.3 t -73.56 -38.68 65.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.808 179.645 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -64.78 -34.58 78.67 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.637 -179.508 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 74.6 t60 . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.66 -179.807 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 95.1 m-20 . . . . . 0 C--O 1.235 0.321 0 CA-C-O 121.054 0.454 . . . . 0.0 110.384 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 90.9 p -58.81 -34.13 71.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.39 -179.633 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -67.05 -49.04 66.46 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.377 179.582 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 138' ' ' ALA . . . . . 0.503 ' O ' HG23 ' B' ' 142' ' ' VAL . . . -56.87 -36.76 70.44 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 120.845 -0.342 . . . . 0.0 110.232 -179.872 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 139' ' ' ALA . . . . . 0.405 ' HB1' ' HB3' ' A' ' 36' ' ' LEU . . . -66.22 -53.41 37.47 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.498 179.415 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -59.75 -46.02 90.43 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.907 -179.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 65.2 tt0 -58.14 -51.08 71.19 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.278 0.561 . . . . 0.0 110.385 -179.777 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 142' ' ' VAL . . . . . 0.503 HG23 ' O ' ' B' ' 138' ' ' ALA . 70.8 t -61.66 -44.96 99.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.992 179.703 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -57.36 -42.6 82.34 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 74.9 m -57.36 -44.11 84.09 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 179.823 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 19.7 m -63.99 -48.52 76.09 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.639 179.437 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 80.3 mt -63.69 -22.55 66.96 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.498 -179.78 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 147' ' ' GLN . . . . . 0.536 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 58.8 tt0 -75.21 -58.43 3.28 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.679 179.374 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -59.96 -54.32 47.51 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.91 -179.308 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.551 ' O ' ' O ' ' B' ' 150' ' ' ALA . 3.9 mm? -48.65 -30.89 5.95 Favored 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 -179.076 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 150' ' ' ALA . . . . . 0.551 ' O ' ' O ' ' B' ' 149' ' ' LEU . . . -56.37 -134.47 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 120.465 -0.494 . . . . 0.0 110.52 179.175 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 151' ' ' THR . . . . . 0.493 ' O ' ' O ' ' B' ' 150' ' ' ALA . 12.3 p 53.62 115.83 0.01 OUTLIER Pre-proline 0 C--N 1.32 -0.677 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.779 -179.804 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_exo -49.07 -44.27 33.47 Favored 'Trans proline' 0 N--CA 1.497 1.701 0 C-N-CA 122.118 1.879 . . . . 0.0 112.991 -179.742 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 6.9 t -59.11 -46.21 88.9 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.94 -178.859 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 16.0 tpp180 -62.96 -36.8 84.67 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.425 -179.715 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 155' ' ' LEU . . . . . 0.464 ' O ' HG23 ' B' ' 159' ' ' THR . 1.9 mm? -62.88 -54.11 43.81 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.384 -0.526 . . . . 0.0 110.821 -179.09 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 156' ' ' MET . . . . . 0.455 ' O ' ' OG1' ' B' ' 159' ' ' THR . 0.0 OUTLIER -57.72 -49.34 76.89 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.063 -0.655 . . . . 0.0 110.614 -179.416 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 157' ' ' ILE . . . . . 0.401 HD13 ' HA ' ' B' ' 157' ' ' ILE . 39.0 mm -62.63 -42.71 97.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-O 121.218 0.533 . . . . 0.0 110.337 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 48.6 tp -62.22 -43.03 99.74 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.769 -179.787 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 159' ' ' THR . . . . . 0.464 HG23 ' O ' ' B' ' 155' ' ' LEU . 23.4 p -60.52 -37.08 80.0 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.913 -0.403 . . . . 0.0 109.913 -179.455 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 75.7 mt-30 -62.71 -46.13 89.57 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.256 -0.577 . . . . 0.0 110.037 179.142 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 161' ' ' LEU . . . . . . . . . . . . . 98.2 mt -64.79 -42.87 94.72 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 120.786 -0.365 . . . . 0.0 110.908 179.63 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 162' ' ' ARG . . . . . 0.525 ' NH1' ' OD1' ' B' ' 218' ' ' ASP . 68.4 ttp85 -51.73 -18.24 1.17 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.395 -179.799 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 61.1 t30 -75.26 -75.05 0.18 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.676 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . -178.42 -141.99 4.55 Favored Glycine 0 CA--C 1.534 1.225 0 C-N-CA 120.487 -0.863 . . . . 0.0 111.199 -179.65 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -49.25 132.77 29.22 Favored 'Trans proline' 0 N--CA 1.493 1.477 0 C-N-CA 122.149 1.899 . . . . 0.0 112.338 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -138.3 67.48 46.37 Favored Pre-proline 0 CA--C 1.536 0.416 0 CA-C-O 121.558 0.694 . . . . 0.0 111.362 -179.856 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -51.97 147.93 24.79 Favored 'Trans proline' 0 C--N 1.298 -2.082 0 C-N-CA 121.772 1.648 . . . . 0.0 111.347 178.24 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . 22.1 t -53.17 -50.39 46.46 Favored 'Isoleucine or valine' 0 C--O 1.237 0.417 0 CA-C-O 121.162 0.505 . . . . 0.0 110.556 -178.296 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 169' ' ' THR . . . . . . . . . . . . . 59.1 p -63.97 -37.8 88.73 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.477 179.274 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -63.57 -41.2 98.4 Favored 'General case' 0 CA--C 1.513 -0.455 0 CA-C-O 121.249 0.547 . . . . 0.0 109.987 179.191 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 171' ' ' LEU . . . . . 0.7 ' C ' HD13 ' B' ' 171' ' ' LEU . 2.8 tm? -61.95 -46.83 87.58 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 119.706 -0.798 . . . . 0.0 109.96 -179.628 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 172' ' ' ALA . . . . . 0.513 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -52.49 -47.85 66.31 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 120.558 -0.457 . . . . 0.0 109.955 179.441 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 44.7 tp10 -54.81 -48.5 72.7 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.425 -0.51 . . . . 0.0 110.531 179.669 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -56.32 -54.93 39.59 Favored 'General case' 0 C--O 1.232 0.157 0 C-N-CA 120.581 -0.448 . . . . 0.0 110.959 -179.352 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 96.3 mt -88.89 -73.91 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.398 179.706 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 176' ' ' GLY . . . . . 0.513 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 132.24 97.53 0.69 Allowed Glycine 0 CA--C 1.523 0.534 0 N-CA-C 111.405 -0.678 . . . . 0.0 111.405 179.824 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 78.3 mtm 58.09 78.06 0.26 Allowed 'General case' 0 CA--C 1.521 -0.148 0 C-N-CA 121.04 -0.264 . . . . 0.0 110.947 179.141 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -174.19 32.23 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.02 0.438 . . . . 0.0 110.115 179.676 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 179' ' ' GLN . . . . . 0.621 ' H ' ' CD ' ' B' ' 179' ' ' GLN . 0.0 OUTLIER -82.21 -25.68 33.98 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.514 -179.017 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 180' ' ' SER . . . . . 0.526 ' O ' ' ND1' ' B' ' 184' ' ' HIS . 34.3 m -65.49 -42.98 91.57 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.589 -179.916 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -69.0 -36.91 78.34 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.633 179.826 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 54.5 t -69.8 -51.84 36.97 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.279 0 C-N-CA 120.501 -0.48 . . . . 0.0 110.785 179.791 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 48.0 t -60.05 -44.94 94.33 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.277 -0.569 . . . . 0.0 110.583 179.606 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 184' ' ' HIS . . . . . 0.588 ' CG ' HH21 ' B' ' 187' ' ' ARG . 0.9 OUTLIER -56.92 -47.61 80.19 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.395 -179.797 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -58.42 -43.07 88.51 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.967 179.699 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 186' ' ' LEU . . . . . 0.519 HD13 HG21 ' B' ' 195' ' ' VAL . 3.3 mm? -60.53 -43.96 96.58 Favored 'General case' 0 CA--C 1.511 -0.535 0 C-N-CA 120.646 -0.421 . . . . 0.0 110.558 -179.723 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 187' ' ' ARG . . . . . 0.588 HH21 ' CG ' ' B' ' 184' ' ' HIS . 86.9 mtm180 -61.32 -40.65 94.98 Favored 'General case' 0 C--N 1.312 -1.043 0 C-N-CA 120.46 -0.496 . . . . 0.0 110.463 -180.0 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 188' ' ' VAL . . . . . 0.494 HG23 ' O ' ' B' ' 184' ' ' HIS . 97.3 t -59.15 -52.36 61.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 C-N-CA 120.352 -0.539 . . . . 0.0 109.701 -179.533 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 189' ' ' LEU . . . . . 0.437 ' N ' HD12 ' B' ' 189' ' ' LEU . 10.9 mp -67.18 -31.81 72.46 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.954 0.407 . . . . 0.0 110.341 179.078 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 190' ' ' ARG . . . . . 0.666 HH12 ' N ' ' B' ' 197' ' ' GLY . 9.6 tpt180 -54.44 -43.49 71.65 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.867 -179.137 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 10.9 m120 -61.0 -43.59 98.67 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.329 -0.549 . . . . 0.0 110.283 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 192' ' ' LEU . . . . . . . . . . . . . 10.7 mt -64.75 -39.09 93.05 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.948 0.404 . . . . 0.0 110.359 179.815 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 99.12 35.43 4.78 Favored Glycine 0 CA--C 1.524 0.621 0 N-CA-C 111.056 -0.818 . . . . 0.0 111.056 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 17.5 mt -98.7 -18.43 18.04 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.866 0.365 . . . . 0.0 110.773 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 195' ' ' VAL . . . . . 0.519 HG21 HD13 ' B' ' 186' ' ' LEU . 14.1 m -134.39 157.75 41.6 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.268 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.003 -179.912 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 196' ' ' VAL . . . . . 0.484 HG12 ' N ' ' B' ' 197' ' ' GLY . 60.8 t -137.98 158.06 32.77 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.239 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.265 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 197' ' ' GLY . . . . . 0.666 ' N ' HH12 ' B' ' 190' ' ' ARG . . . -135.75 132.69 6.27 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 179.37 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 9.7 t0 . . . . . 0 N--CA 1.463 0.196 0 CA-C-O 120.865 0.364 . . . . 0.0 110.572 179.763 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 89.2 t . . . . . 0 CA--C 1.522 -0.125 0 CA-C-O 120.661 0.267 . . . . 0.0 110.41 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 89.9 m-85 -94.98 127.74 41.26 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.384 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 30.4 p -150.33 165.53 32.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.879 -179.042 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 208' ' ' LEU . . . . . 0.739 HD22 ' N ' ' B' ' 208' ' ' LEU . 2.6 mm? -67.3 147.84 52.45 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.898 -179.186 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 209' ' ' TYR . . . . . 0.469 ' C ' ' CD1' ' B' ' 209' ' ' TYR . 17.0 t80 -59.05 -49.22 78.73 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.405 -179.662 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 210' ' ' ASP . . . . . 0.529 ' OD1' ' N ' ' B' ' 211' ' ' THR . 53.5 t0 -102.63 155.7 18.12 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.602 -179.596 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 211' ' ' THR . . . . . 0.529 ' N ' ' OD1' ' B' ' 210' ' ' ASP . 23.8 p -92.78 -24.24 18.61 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.005 0.431 . . . . 0.0 110.348 179.629 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 212' ' ' HIS . . . . . . . . . . . . . 88.3 m-70 -57.15 -48.14 79.43 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.204 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 213' ' ' VAL . . . . . 0.557 HG13 ' N ' ' B' ' 214' ' ' ALA . 9.6 p -55.35 -44.93 77.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 N-CA-C 109.862 -0.422 . . . . 0.0 109.862 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 214' ' ' ALA . . . . . 0.557 ' N ' HG13 ' B' ' 213' ' ' VAL . . . -54.98 -42.86 72.96 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.186 179.583 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 9.6 tp-100 -61.68 -39.67 92.26 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.093 179.545 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 216' ' ' LEU . . . . . 0.428 ' CD1' ' HB2' ' A' ' 101' ' ' ALA . 15.2 tp -59.89 -43.36 94.85 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.585 -0.446 . . . . 0.0 109.883 -179.489 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 217' ' ' LEU . . . . . 0.444 ' O ' HG22 ' B' ' 221' ' ' ILE . 4.2 mm? -64.32 -37.73 88.53 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.408 179.193 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 218' ' ' ASP . . . . . 0.525 ' OD1' ' NH1' ' B' ' 162' ' ' ARG . 98.6 m-20 -60.44 -39.78 88.75 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.122 0.487 . . . . 0.0 110.408 -179.735 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 219' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -72.84 -47.43 46.31 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.496 -0.482 . . . . 0.0 110.696 179.366 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 220' ' ' ALA . . . . . 0.514 ' HB2' ' CD1' ' A' ' 97' ' ' LEU . . . -62.85 -51.11 68.3 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.888 0.375 . . . . 0.0 111.19 -179.847 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 221' ' ' ILE . . . . . 0.558 HG23 ' N ' ' B' ' 222' ' ' TYR . 10.9 tp -58.65 -47.13 89.69 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.363 -178.931 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 222' ' ' TYR . . . . . 0.558 ' N ' HG23 ' B' ' 221' ' ' ILE . 89.1 t80 -60.24 -39.7 87.64 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.258 179.863 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 223' ' ' HIS . . . . . 0.514 ' CE1' ' OD2' ' A' ' 91' ' ' ASP . 0.9 OUTLIER -60.89 -41.91 96.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.979 179.659 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 6.2 t -73.58 -38.34 65.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.923 0.392 . . . . 0.0 110.889 179.589 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 80.1 tt0 -64.82 -35.14 80.15 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.681 -179.504 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 76.6 t60 . . . . . 0 C--N 1.327 -0.388 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.649 -179.839 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 . . . . . 0 C--O 1.238 0.461 0 CA-C-O 121.321 0.581 . . . . 0.0 111.022 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 87.8 p -57.66 -33.11 67.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.271 -179.646 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 94.1 mm-40 -67.14 -50.73 60.25 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.282 179.752 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.471 ' O ' HG23 ' A' ' 23' ' ' VAL . . . -56.05 -34.83 66.26 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.031 -179.656 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.66 -53.09 24.5 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 121.275 0.56 . . . . 0.0 110.422 179.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.96 -46.18 90.25 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.246 179.845 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.477 ' N ' ' OE1' ' A' ' 22' ' ' GLN . 0.9 OUTLIER -60.09 -52.26 66.13 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.037 0.446 . . . . 0.0 110.606 -179.574 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.471 HG23 ' O ' ' A' ' 19' ' ' ALA . 77.5 t -62.3 -46.91 95.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 C-N-CA 120.457 -0.497 . . . . 0.0 110.06 -179.934 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -50.47 -47.91 56.87 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-O 120.99 0.424 . . . . 0.0 110.224 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.5 t -59.38 -42.84 92.58 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.342 179.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 95.0 m -61.42 -51.2 69.73 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.766 -179.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.45 ' N ' ' CD1' ' A' ' 27' ' ' LEU . 7.6 mp -67.17 -22.14 65.77 Favored 'General case' 0 CA--C 1.523 -0.075 0 CA-C-O 120.763 0.316 . . . . 0.0 110.645 179.759 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.498 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 7.8 tt0 -71.26 -62.48 1.39 Allowed 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.526 179.112 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.414 ' HB1' ' NH1' ' A' ' 35' ' ' ARG . . . -57.25 -53.68 55.42 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 120.753 -0.379 . . . . 0.0 110.591 -179.346 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.493 ' O ' ' O ' ' A' ' 31' ' ' ALA . 85.7 mt -46.54 -31.4 2.75 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.417 -178.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.498 ' HB3' ' O ' ' A' ' 28' ' ' GLN . . . -57.06 -127.87 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.423 0 O-C-N 123.667 0.604 . . . . 0.0 110.339 179.522 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.43 ' O ' ' O ' ' A' ' 31' ' ' ALA . 0.5 OUTLIER 53.88 108.26 0.02 OUTLIER Pre-proline 0 CA--C 1.544 0.738 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.592 179.973 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -48.48 -56.01 3.54 Favored 'Trans proline' 0 N--CA 1.494 1.535 0 C-N-CA 122.061 1.841 . . . . 0.0 113.282 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 79.9 p -59.88 -46.19 90.1 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.097 -178.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.418 ' HB3' ' HG1' ' A' ' 32' ' ' THR . 35.5 ttm180 -62.78 -43.4 98.91 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.426 -179.786 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.56 HD23 ' O ' ' A' ' 36' ' ' LEU . 1.9 tt -61.46 -53.37 57.4 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.675 -178.785 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.606 ' CE ' HE21 ' A' ' 41' ' ' GLN . 11.0 tpt -51.55 -48.74 62.97 Favored 'General case' 0 C--O 1.242 0.66 0 C-N-CA 120.338 -0.545 . . . . 0.0 110.419 -179.788 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 96.6 mt -60.8 -46.48 96.07 Favored 'Isoleucine or valine' 0 C--O 1.243 0.72 0 CA-C-O 121.545 0.688 . . . . 0.0 110.375 -179.264 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 72.6 mt -59.98 -41.4 91.92 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.14 179.813 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 13.8 m -55.48 -43.08 75.21 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.119 179.698 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.606 HE21 ' CE ' ' A' ' 37' ' ' MET . 99.2 mm-40 -61.52 -44.21 97.47 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.401 -0.52 . . . . 0.0 110.72 179.676 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.569 HD11 ' O ' ' A' ' 87' ' ' TYR . 13.7 tp -68.57 -44.3 74.75 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.335 -0.546 . . . . 0.0 111.323 180.0 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 89.3 mtm-85 -49.18 -17.14 0.2 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.322 -178.879 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.417 ' N ' ' C ' ' A' ' 42' ' ' LEU . 60.9 t-20 -147.06 65.22 1.16 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.086 179.795 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 159.29 82.01 0.04 OUTLIER Glycine 0 CA--C 1.529 0.937 0 N-CA-C 111.121 -0.792 . . . . 0.0 111.121 -179.866 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_exo -69.77 113.34 3.34 Favored 'Trans proline' 0 N--CA 1.497 1.711 0 C-N-CA 123.172 2.581 . . . . 0.0 111.061 178.786 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.554 HD12 ' O ' ' A' ' 47' ' ' LEU . 0.3 OUTLIER -167.15 158.61 10.48 Favored Pre-proline 0 C--N 1.324 -0.531 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.544 -179.171 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -62.71 -171.59 0.11 Allowed 'Trans proline' 0 N--CA 1.497 1.68 0 C-N-CA 122.667 2.245 . . . . 0.0 112.052 178.756 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.548 ' O ' ' N ' ' A' ' 52' ' ' LEU . 46.4 t -75.69 -62.99 1.13 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.353 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.509 -179.918 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.431 ' C ' ' O ' ' A' ' 49' ' ' VAL . 14.5 m -34.7 -49.32 0.41 Allowed 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 121.184 0.516 . . . . 0.0 110.597 -179.268 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -61.79 -44.32 97.12 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.275 178.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.61 HD23 ' O ' ' A' ' 52' ' ' LEU . 1.3 tt -62.47 -38.67 90.73 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.773 -179.919 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.12 -42.02 93.86 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.047 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -62.66 -43.96 97.48 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.134 179.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.99 -54.95 22.4 Favored 'General case' 0 C--N 1.332 -0.159 0 C-N-CA 120.584 -0.446 . . . . 0.0 110.951 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.682 HG23 ' O ' ' A' ' 56' ' ' ILE . 6.8 tt -176.75 86.45 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.456 -0.133 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.761 -179.863 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . 0.508 ' O ' ' N ' ' A' ' 59' ' ' GLU . . . -157.6 -49.79 0.01 OUTLIER Glycine 0 CA--C 1.523 0.544 0 N-CA-C 110.425 -1.07 . . . . 0.0 110.425 178.608 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 99.6 mtp 43.0 17.86 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.747 0.308 . . . . 0.0 110.745 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.508 ' N ' ' O ' ' A' ' 57' ' ' GLY . 95.8 mt-10 -148.31 68.61 1.09 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.152 0.501 . . . . 0.0 109.725 -179.374 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 8.7 mt-30 -58.46 -36.32 73.52 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.798 -179.397 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 37.7 t -62.15 -45.35 93.81 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.777 -179.749 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -61.89 -36.22 80.64 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.293 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 94.0 t -65.41 -50.7 71.21 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 C-N-CA 120.657 -0.417 . . . . 0.0 110.587 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.4 t -57.74 -45.98 85.1 Favored 'General case' 0 C--N 1.332 -0.165 0 C-N-CA 120.722 -0.391 . . . . 0.0 110.331 -179.275 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 48.8 m170 -61.65 -48.0 82.81 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-O 121.191 0.52 . . . . 0.0 110.618 179.803 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 44.5 tt0 -61.83 -40.11 94.14 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.217 -179.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.6 tp -62.39 -43.27 99.21 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.232 -179.472 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -60.7 -42.92 98.13 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 120.827 -0.349 . . . . 0.0 110.732 -179.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 95.8 t -64.88 -54.19 32.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 C-N-CA 119.898 -0.721 . . . . 0.0 110.674 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 96.6 mt -59.48 -40.34 86.67 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 -178.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 62.2 ttp180 -57.97 -41.42 82.91 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.218 179.703 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -58.04 -48.62 79.54 Favored 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 120.596 -0.441 . . . . 0.0 110.539 -179.585 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.536 HD22 ' N ' ' A' ' 73' ' ' LEU . 4.0 mm? -66.36 -41.08 89.98 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.63 179.544 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . 0.433 ' C ' HD12 ' A' ' 75' ' ' LEU . . . 107.42 38.83 2.03 Favored Glycine 0 CA--C 1.525 0.671 0 N-CA-C 111.089 -0.805 . . . . 0.0 111.089 -179.812 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.496 ' N ' HD12 ' A' ' 75' ' ' LEU . 9.9 mp -98.86 -13.22 20.16 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 110.446 -0.205 . . . . 0.0 110.446 179.43 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 23.1 m -136.33 155.53 34.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.404 HG23 ' HA ' ' A' ' 90' ' ' TYR . 24.8 t -139.84 150.23 22.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.663 179.847 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -110.67 158.11 14.59 Favored Glycine 0 CA--C 1.523 0.552 0 N-CA-C 110.153 -1.179 . . . . 0.0 110.153 178.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 . . . . . 0 CA--C 1.515 -0.378 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 -179.922 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 15.5 m . . . . . 0 N--CA 1.467 0.394 0 CA-C-O 120.751 0.31 . . . . 0.0 110.324 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.569 ' O ' HD11 ' A' ' 42' ' ' LEU . 77.5 m-85 -108.03 136.56 47.52 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.279 -179.729 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 47.5 t -150.63 170.03 20.16 Favored 'General case' 0 CA--C 1.514 -0.439 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.428 ' N ' HD22 ' A' ' 89' ' ' LEU . 4.4 mm? -61.66 153.26 28.57 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.737 179.259 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.404 ' HA ' HG23 ' A' ' 77' ' ' VAL . 65.5 t80 -50.51 -45.83 56.83 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.485 179.953 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.498 ' OD2' ' CG ' ' A' ' 93' ' ' HIS . 28.3 t70 -156.88 168.41 27.55 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.937 -0.305 . . . . 0.0 110.507 179.88 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . 0.538 ' O ' ' HB3' ' A' ' 95' ' ' ALA . 64.1 p -68.88 -32.28 71.82 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.838 -179.999 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . 0.498 ' CG ' ' OD2' ' A' ' 91' ' ' ASP . 27.3 m170 -39.46 -67.79 0.2 Allowed 'General case' 0 C--O 1.24 0.56 0 CA-C-O 121.34 0.591 . . . . 0.0 110.716 -179.9 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 57.7 t -45.73 -40.42 3.22 Favored 'Isoleucine or valine' 0 C--O 1.236 0.395 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.32 179.744 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.538 ' HB3' ' O ' ' A' ' 92' ' ' THR . . . -61.49 -38.09 86.04 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.31 -179.989 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -60.74 -44.99 95.98 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.303 0.573 . . . . 0.0 110.028 -179.653 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.518 ' N ' ' CD1' ' A' ' 97' ' ' LEU . 6.4 mp -61.51 -46.32 90.48 Favored 'General case' 0 C--O 1.24 0.592 0 CA-C-O 121.522 0.677 . . . . 0.0 110.193 -179.467 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 17.7 mt -66.61 -33.86 76.59 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.259 179.494 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 91.7 m-20 -59.87 -42.48 93.78 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 -179.597 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -65.45 -48.68 71.85 Favored 'General case' 0 N--CA 1.462 0.149 0 N-CA-C 109.819 -0.438 . . . . 0.0 109.819 179.458 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.26 -44.82 96.63 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.946 179.439 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 5.3 mm -63.63 -46.17 95.56 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.932 -179.824 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 90.2 t80 -63.78 -50.78 67.65 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 120.711 -0.396 . . . . 0.0 110.643 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 56.7 t-80 -59.93 -33.9 72.51 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.677 -179.617 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 7.5 t -76.06 -50.37 14.93 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.866 0.365 . . . . 0.0 111.323 179.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -64.81 -22.03 66.9 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.534 -179.733 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 34.5 t60 . . . . . 0 N--CA 1.452 -0.33 0 C-N-CA 120.551 -0.46 . . . . 0.0 110.524 -179.048 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 . . . . . 0 N--CA 1.469 0.477 0 CA-C-O 121.056 0.455 . . . . 0.0 111.056 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 77.5 p -56.77 -45.66 81.96 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.176 179.237 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 95.5 mm-40 -62.56 -45.73 91.57 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.306 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 138' ' ' ALA . . . . . 0.523 ' O ' HG23 ' B' ' 142' ' ' VAL . . . -56.64 -34.29 67.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.277 -179.886 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.7 -53.26 23.22 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-O 121.045 0.45 . . . . 0.0 110.419 179.394 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -60.17 -46.65 88.96 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 120.604 -0.438 . . . . 0.0 111.356 179.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 141' ' ' GLN . . . . . 0.511 ' N ' ' OE1' ' B' ' 141' ' ' GLN . 0.8 OUTLIER -59.29 -52.57 65.07 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.114 0.483 . . . . 0.0 110.767 -179.439 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 142' ' ' VAL . . . . . 0.523 HG23 ' O ' ' B' ' 138' ' ' ALA . 96.7 t -62.05 -47.09 94.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 C-N-CA 120.395 -0.522 . . . . 0.0 110.113 -179.8 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -50.85 -47.26 60.32 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 120.931 0.396 . . . . 0.0 110.322 -179.649 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 14.4 t -59.28 -42.33 90.99 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.019 179.78 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 96.4 m -62.57 -51.61 66.66 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.406 -0.518 . . . . 0.0 110.806 -179.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 146' ' ' LEU . . . . . 0.423 ' N ' ' CD1' ' B' ' 146' ' ' LEU . 7.8 mp -66.24 -22.62 66.33 Favored 'General case' 0 CA--C 1.523 -0.096 0 CA-C-O 120.807 0.337 . . . . 0.0 110.653 179.602 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 147' ' ' GLN . . . . . 0.495 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 7.8 tt0 -70.89 -63.28 1.13 Allowed 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.593 179.262 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -56.85 -53.28 59.71 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 120.691 -0.404 . . . . 0.0 110.924 -179.297 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.494 ' O ' ' O ' ' B' ' 150' ' ' ALA . 88.9 mt -46.5 -31.0 2.47 Favored 'General case' 0 CA--C 1.511 -0.548 0 C-N-CA 120.956 -0.298 . . . . 0.0 110.503 -179.106 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 150' ' ' ALA . . . . . 0.495 ' HB3' ' O ' ' B' ' 147' ' ' GLN . . . -57.57 -128.58 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.454 0 O-C-N 123.54 0.525 . . . . 0.0 110.517 179.511 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 151' ' ' THR . . . . . 0.436 ' O ' ' O ' ' B' ' 150' ' ' ALA . 0.6 OUTLIER 53.81 107.39 0.02 OUTLIER Pre-proline 0 CA--C 1.543 0.677 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.554 179.946 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -47.9 -59.25 1.32 Allowed 'Trans proline' 0 N--CA 1.494 1.533 0 C-N-CA 122.122 1.881 . . . . 0.0 113.338 -179.811 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 78.2 p -56.6 -46.6 80.78 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.055 -178.76 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 154' ' ' ARG . . . . . 0.401 ' HB3' ' HG1' ' B' ' 151' ' ' THR . 36.1 ttm180 -62.4 -43.33 99.07 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.451 179.795 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 155' ' ' LEU . . . . . 0.53 HD23 ' O ' ' B' ' 155' ' ' LEU . 1.8 tt -61.05 -53.88 51.75 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 120.468 -0.493 . . . . 0.0 110.582 -178.733 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 156' ' ' MET . . . . . 0.581 ' CE ' HE21 ' B' ' 160' ' ' GLN . 11.0 tpt -51.16 -48.86 61.78 Favored 'General case' 0 C--O 1.24 0.584 0 C-N-CA 120.178 -0.609 . . . . 0.0 110.425 -179.741 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 96.3 mt -59.94 -47.33 92.07 Favored 'Isoleucine or valine' 0 C--O 1.244 0.785 0 CA-C-O 121.715 0.769 . . . . 0.0 110.29 -179.417 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 75.3 mt -59.11 -41.89 89.24 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.053 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 13.6 m -54.77 -43.53 72.88 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.354 179.718 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 160' ' ' GLN . . . . . 0.581 HE21 ' CE ' ' B' ' 156' ' ' MET . 98.9 mm-40 -60.72 -44.68 96.32 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.393 -0.523 . . . . 0.0 110.574 179.725 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 161' ' ' LEU . . . . . 0.589 HD11 ' O ' ' B' ' 206' ' ' TYR . 13.4 tp -68.43 -43.73 76.47 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.351 -0.54 . . . . 0.0 111.401 179.887 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 162' ' ' ARG . . . . . . . . . . . . . 88.5 mtm-85 -50.04 -19.63 0.77 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.355 -178.8 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 55.3 t-20 -142.89 64.81 1.35 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.057 179.836 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . 156.81 88.72 0.07 OUTLIER Glycine 0 CA--C 1.539 1.579 0 N-CA-C 110.978 -0.849 . . . . 0.0 110.978 179.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -77.87 113.98 3.55 Favored 'Trans proline' 0 N--CA 1.496 1.639 0 C-N-CA 122.518 2.145 . . . . 0.0 110.966 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 166' ' ' LEU . . . . . 0.547 ' O ' HD12 ' B' ' 166' ' ' LEU . 0.3 OUTLIER -164.98 158.29 14.29 Favored Pre-proline 0 C--N 1.325 -0.462 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.711 -178.663 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_endo -61.08 -172.02 0.08 OUTLIER 'Trans proline' 0 N--CA 1.496 1.621 0 C-N-CA 122.871 2.381 . . . . 0.0 112.1 178.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 168' ' ' VAL . . . . . 0.554 ' O ' ' N ' ' B' ' 171' ' ' LEU . 47.1 t -75.39 -62.85 1.18 Allowed 'Isoleucine or valine' 0 C--O 1.224 -0.282 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.504 -179.786 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 169' ' ' THR . . . . . 0.423 ' C ' ' O ' ' B' ' 168' ' ' VAL . 17.3 m -34.58 -48.72 0.38 Allowed 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 121.126 0.488 . . . . 0.0 110.624 -179.157 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -62.44 -44.14 97.14 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.285 178.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 171' ' ' LEU . . . . . 0.602 HD23 ' O ' ' B' ' 171' ' ' LEU . 1.2 tt -62.37 -39.32 92.79 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.226 0.536 . . . . 0.0 109.812 -179.819 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 172' ' ' ALA . . . . . . . . . . . . . . . -60.7 -42.29 96.91 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.328 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -62.25 -43.02 99.78 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.112 179.777 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -66.76 -54.54 21.78 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.587 -0.445 . . . . 0.0 110.931 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 175' ' ' ILE . . . . . 0.687 ' O ' HG23 ' B' ' 175' ' ' ILE . 8.8 tt -176.97 86.97 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.456 -0.147 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.719 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 176' ' ' GLY . . . . . 0.533 ' O ' ' N ' ' B' ' 178' ' ' GLU . . . -157.56 -49.0 0.01 OUTLIER Glycine 0 CA--C 1.522 0.471 0 N-CA-C 110.528 -1.029 . . . . 0.0 110.528 178.611 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 97.6 mtp 41.81 19.42 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.139 0 CA-C-O 120.787 0.327 . . . . 0.0 110.755 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 178' ' ' GLU . . . . . 0.533 ' N ' ' O ' ' B' ' 176' ' ' GLY . 94.3 mt-10 -150.06 67.05 0.97 Allowed 'General case' 0 CA--C 1.52 -0.195 0 CA-C-O 121.049 0.452 . . . . 0.0 109.989 -179.342 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 9.1 mt-30 -57.09 -37.28 71.67 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.863 -179.64 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 44.5 t -61.97 -45.95 91.42 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.805 -179.76 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -61.62 -36.4 80.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.404 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 95.5 t -64.91 -50.71 73.79 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 C-N-CA 120.593 -0.443 . . . . 0.0 110.656 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 12.0 t -58.31 -45.23 88.43 Favored 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.086 -178.864 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 46.6 m170 -61.67 -47.67 84.29 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-O 121.209 0.528 . . . . 0.0 110.656 179.591 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 43.2 tt0 -62.1 -40.21 95.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.234 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 186' ' ' LEU . . . . . 0.418 HD21 ' CD1' ' B' ' 206' ' ' TYR . 6.9 tp -62.63 -43.2 99.4 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.404 -179.658 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -60.2 -42.8 95.86 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.754 -0.379 . . . . 0.0 110.315 179.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 73.9 t -64.69 -54.39 30.75 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.211 0 C-N-CA 119.898 -0.721 . . . . 0.0 110.558 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 189' ' ' LEU . . . . . 0.402 HD23 ' HA ' ' B' ' 189' ' ' LEU . 98.5 mt -59.67 -40.95 89.49 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 -178.704 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 62.1 ttp180 -56.95 -42.25 79.74 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.29 179.775 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 40.6 t30 -57.03 -50.79 71.66 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.586 -0.446 . . . . 0.0 110.487 -179.671 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 192' ' ' LEU . . . . . 0.532 ' N ' HD22 ' B' ' 192' ' ' LEU . 3.9 mm? -64.45 -41.69 96.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.646 179.819 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 193' ' ' GLY . . . . . 0.419 ' C ' HD12 ' B' ' 194' ' ' LEU . . . 107.89 38.01 2.09 Favored Glycine 0 CA--C 1.524 0.613 0 N-CA-C 111.13 -0.788 . . . . 0.0 111.13 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 194' ' ' LEU . . . . . 0.506 ' N ' HD12 ' B' ' 194' ' ' LEU . 9.8 mp -97.49 -12.97 22.01 Favored 'General case' 0 N--CA 1.466 0.371 0 O-C-N 122.766 -0.255 . . . . 0.0 110.394 179.355 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 26.2 m -137.21 156.23 33.43 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.384 0 N-CA-C 109.981 -0.378 . . . . 0.0 109.981 -179.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 196' ' ' VAL . . . . . . . . . . . . . 29.9 t -141.42 152.55 19.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.451 179.583 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 197' ' ' GLY . . . . . . . . . . . . . . . -112.1 160.65 13.06 Favored Glycine 0 CA--C 1.522 0.509 0 N-CA-C 110.379 -1.088 . . . . 0.0 110.379 179.365 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 95.3 m-20 . . . . . 0 CA--C 1.515 -0.392 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 -179.997 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 12.3 m . . . . . 0 N--CA 1.468 0.435 0 CA-C-O 120.8 0.333 . . . . 0.0 110.327 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 206' ' ' TYR . . . . . 0.589 ' O ' HD11 ' B' ' 161' ' ' LEU . 79.7 m-85 -108.53 137.22 46.84 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.303 -179.813 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 40.1 t -150.75 169.93 20.45 Favored 'General case' 0 C--O 1.222 -0.391 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 208' ' ' LEU . . . . . 0.427 HD22 ' N ' ' B' ' 208' ' ' LEU . 4.4 mm? -62.27 153.69 29.96 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.718 179.23 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -50.51 -46.77 57.37 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.479 179.761 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 210' ' ' ASP . . . . . 0.523 ' OD2' ' CG ' ' B' ' 212' ' ' HIS . 31.5 t70 -156.42 166.14 34.3 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.911 0.386 . . . . 0.0 110.485 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 211' ' ' THR . . . . . 0.561 ' O ' ' HB3' ' B' ' 214' ' ' ALA . 74.1 p -67.27 -32.09 72.87 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.622 -179.773 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 212' ' ' HIS . . . . . 0.523 ' CG ' ' OD2' ' B' ' 210' ' ' ASP . 29.9 m170 -39.46 -67.49 0.22 Allowed 'General case' 0 C--O 1.238 0.457 0 CA-C-O 121.308 0.575 . . . . 0.0 110.779 -179.936 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 59.3 t -45.99 -39.24 3.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.336 179.561 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 214' ' ' ALA . . . . . 0.561 ' HB3' ' O ' ' B' ' 211' ' ' THR . . . -62.49 -38.18 88.87 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.339 179.83 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 57.5 tt0 -60.44 -44.89 95.36 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.247 0.546 . . . . 0.0 109.994 -179.743 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 216' ' ' LEU . . . . . 0.524 ' CD1' ' N ' ' B' ' 216' ' ' LEU . 6.3 mp -61.99 -45.73 92.35 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-O 121.431 0.634 . . . . 0.0 110.39 -179.567 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 67.1 mt -66.55 -34.97 79.09 Favored 'General case' 0 C--O 1.218 -0.571 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.118 179.444 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -60.07 -42.67 95.06 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 -179.735 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 219' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -64.6 -47.79 77.3 Favored 'General case' 0 CA--C 1.52 -0.187 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 179.429 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 220' ' ' ALA . . . . . 0.414 ' HA ' HD21 ' A' ' 97' ' ' LEU . . . -62.94 -44.42 96.11 Favored 'General case' 0 CA--C 1.518 -0.262 0 C-N-CA 120.643 -0.423 . . . . 0.0 111.098 179.28 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 5.2 mm -63.93 -45.68 96.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 C-N-CA 120.729 -0.388 . . . . 0.0 110.98 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 89.7 t80 -63.65 -50.35 69.65 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.564 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 223' ' ' HIS . . . . . . . . . . . . . 52.0 t-80 -60.58 -33.34 72.58 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.691 -179.721 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 10.6 t -76.4 -50.79 13.26 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.918 0.39 . . . . 0.0 111.501 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -64.34 -24.16 67.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.705 -179.793 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 32.9 t60 . . . . . 0 C--N 1.33 -0.277 0 C-N-CA 120.552 -0.459 . . . . 0.0 110.476 -179.18 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . 0.431 ' O ' ' OD1' ' A' ' 16' ' ' ASP . 66.8 t0 . . . . . 0 N--CA 1.464 0.273 0 CA-C-O 120.953 0.406 . . . . 0.0 110.769 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 83.8 p -45.25 -50.78 11.49 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.147 179.246 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -63.44 -42.18 98.66 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.078 179.739 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.463 ' O ' HG23 ' A' ' 23' ' ' VAL . . . -57.49 -35.57 70.38 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.25 179.714 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.64 -53.47 33.69 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 110.181 -0.303 . . . . 0.0 110.181 179.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.46 -40.42 94.44 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.682 -179.644 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -61.33 -52.42 64.74 Favored 'General case' 0 C--O 1.242 0.704 0 CA-C-O 121.265 0.555 . . . . 0.0 110.48 -179.883 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.463 HG23 ' O ' ' A' ' 19' ' ' ALA . 83.5 t -62.18 -46.19 97.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.052 179.616 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -52.93 -43.63 66.41 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 120.87 -0.332 . . . . 0.0 110.207 179.748 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.9 t -59.16 -43.23 92.08 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.234 -0.439 . . . . 0.0 109.927 179.879 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 97.2 m -62.43 -51.47 67.41 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 120.539 -0.464 . . . . 0.0 110.532 179.729 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.46 ' N ' ' CD1' ' A' ' 27' ' ' LEU . 7.5 mp -65.51 -20.46 66.35 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 116.563 -0.289 . . . . 0.0 110.68 179.61 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.516 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 58.8 tt0 -74.04 -60.99 2.01 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.504 179.577 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.447 ' HB1' HH12 ' A' ' 35' ' ' ARG . . . -59.68 -54.43 46.53 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.802 -179.385 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.531 HD13 HD13 ' A' ' 39' ' ' LEU . 4.0 mm? -47.73 -30.44 3.87 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.187 -179.205 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.516 ' HB3' ' O ' ' A' ' 28' ' ' GLN . . . -58.9 -141.4 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.231 0.539 . . . . 0.0 110.453 179.661 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.407 ' O ' ' O ' ' A' ' 31' ' ' ALA . 3.3 m 59.48 115.76 0.02 OUTLIER Pre-proline 0 CA--C 1.541 0.609 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.149 -179.882 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -47.86 -53.15 7.02 Favored 'Trans proline' 0 C--N 1.31 -1.486 0 C-N-CA 122.306 2.004 . . . . 0.0 113.34 -179.068 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 78.0 p -53.01 -48.17 67.75 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.085 -178.576 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.447 HH12 ' HB1' ' A' ' 29' ' ' ALA . 82.8 mtp180 -67.77 -37.88 82.68 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 120.812 -0.355 . . . . 0.0 110.497 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.498 HD13 ' O ' ' A' ' 36' ' ' LEU . 0.2 OUTLIER -60.74 -52.76 63.73 Favored 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 120.25 -0.58 . . . . 0.0 110.86 -178.289 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.615 ' SD ' HD11 ' A' ' 56' ' ' ILE . 5.3 ttt -62.06 -48.12 81.67 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.755 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 94.7 mt -60.63 -45.65 97.04 Favored 'Isoleucine or valine' 0 C--O 1.243 0.741 0 CA-C-O 121.328 0.585 . . . . 0.0 110.481 -179.491 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.531 HD13 HD13 ' A' ' 30' ' ' LEU . 43.9 mt -60.68 -40.63 92.85 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.319 179.524 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 19.3 m -59.32 -43.17 92.71 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.024 179.062 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 67.0 tp60 -54.97 -47.03 75.1 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-O 120.984 0.421 . . . . 0.0 109.94 179.863 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.404 ' HA ' HD23 ' A' ' 42' ' ' LEU . 27.9 mt -65.89 -38.47 88.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.928 179.249 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 53.8 ttp180 -54.75 -44.08 73.3 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.09 -178.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -134.27 62.09 1.66 Allowed 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.844 0.354 . . . . 0.0 110.21 179.651 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 177.18 80.24 0.05 OUTLIER Glycine 0 CA--C 1.533 1.202 0 N-CA-C 110.686 -0.966 . . . . 0.0 110.686 -179.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -77.56 104.91 1.95 Allowed 'Trans proline' 0 N--CA 1.494 1.536 0 C-N-CA 122.491 2.128 . . . . 0.0 111.861 -179.365 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.524 ' H ' HD12 ' A' ' 47' ' ' LEU . 0.2 OUTLIER -155.88 156.43 30.54 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.342 -179.414 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -65.45 175.51 4.14 Favored 'Trans proline' 0 C--N 1.308 -1.595 0 C-N-CA 122.83 2.353 . . . . 0.0 111.975 179.633 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.545 HG23 ' N ' ' A' ' 50' ' ' THR . 5.1 m -63.91 -43.85 97.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.383 0.611 . . . . 0.0 110.994 -179.743 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.545 ' N ' HG23 ' A' ' 49' ' ' VAL . 0.2 OUTLIER -58.08 -65.78 0.59 Allowed 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.359 -179.718 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.467 ' H ' HG23 ' A' ' 50' ' ' THR . 41.2 t0 -50.68 -36.49 36.14 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 -179.61 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 9.5 tt -63.12 -41.51 99.34 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.31 179.317 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.26 -42.76 99.62 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-O 120.896 0.379 . . . . 0.0 110.241 -179.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -62.41 -41.72 98.9 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.113 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -66.68 -52.94 39.05 Favored 'General case' 0 CA--C 1.521 -0.157 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.847 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.718 HG23 ' O ' ' A' ' 56' ' ' ILE . 7.7 tt -175.07 84.1 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.881 -179.871 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -167.01 -59.29 0.03 OUTLIER Glycine 0 CA--C 1.525 0.688 0 N-CA-C 110.523 -1.031 . . . . 0.0 110.523 178.684 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 70.7 mtm 54.0 29.93 10.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.867 0.365 . . . . 0.0 110.451 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.522 ' O ' ' N ' ' A' ' 61' ' ' SER . 19.9 pt-20 -163.99 39.54 0.09 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.593 -179.879 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -40.54 -22.99 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.588 179.692 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.531 ' O ' ' ND1' ' A' ' 65' ' ' HIS . 78.0 p -67.84 -42.55 81.22 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.387 179.883 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.469 ' N ' ' O ' ' A' ' 59' ' ' GLU . . . -66.23 -35.15 79.68 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.313 179.539 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 92.1 t -66.99 -47.94 80.85 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.645 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 75.4 m -60.23 -43.14 96.29 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 120.926 -0.31 . . . . 0.0 110.473 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' HIS . . . . . 0.531 ' ND1' ' O ' ' A' ' 61' ' ' SER . 35.3 m80 -63.72 -49.94 71.09 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.608 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 93.9 mt-30 -63.71 -37.65 88.15 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.315 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 5.0 tt -62.28 -44.96 95.33 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.549 179.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 19.4 mmm180 -61.92 -41.93 98.5 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.839 0.352 . . . . 0.0 110.39 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 88.9 t -62.7 -55.13 25.67 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.133 0 C-N-CA 119.993 -0.683 . . . . 0.0 110.066 -179.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 81.2 mt -60.86 -35.47 76.68 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.29 -0.414 . . . . 0.0 109.948 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -57.83 -42.03 83.5 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.361 179.843 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -59.68 -45.9 90.7 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.497 -0.481 . . . . 0.0 110.383 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.547 HD22 ' N ' ' A' ' 73' ' ' LEU . 3.9 mm? -67.87 -41.8 82.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.762 179.505 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 109.76 91.77 2.15 Favored Glycine 0 CA--C 1.522 0.531 0 N-CA-C 110.953 -0.859 . . . . 0.0 110.953 -179.66 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 55.2 tp -156.84 -25.81 0.09 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.755 0.312 . . . . 0.0 110.577 179.401 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 19.2 m -136.98 158.82 36.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.46 179.833 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.481 HG12 ' N ' ' A' ' 78' ' ' GLY . 71.5 t -143.85 157.33 16.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.393 -179.761 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . 0.481 ' N ' HG12 ' A' ' 77' ' ' VAL . . . -124.22 143.4 14.77 Favored Glycine 0 N--CA 1.462 0.382 0 N-CA-C 110.385 -1.086 . . . . 0.0 110.385 179.169 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 . . . . . 0 CA--C 1.514 -0.408 0 N-CA-C 110.024 -0.361 . . . . 0.0 110.024 -179.557 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 60.2 t . . . . . 0 N--CA 1.465 0.278 0 CA-C-O 120.864 0.364 . . . . 0.0 110.791 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 43.0 m-85 -100.38 132.9 45.5 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.298 178.795 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 48.2 t -150.73 170.97 17.93 Favored 'General case' 0 C--N 1.338 0.095 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.063 -179.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 47.2 mt -71.03 149.85 46.18 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.457 -179.718 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.421 ' O ' ' OD1' ' A' ' 91' ' ' ASP . 1.5 t80 -52.68 -51.34 60.65 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.485 -179.471 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.421 ' OD1' ' O ' ' A' ' 90' ' ' TYR . 98.9 m-20 -139.34 -171.15 3.06 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.412 -179.527 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 66.0 p -96.62 9.14 42.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.458 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 18.1 t-160 -52.39 -67.59 0.24 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.468 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 28.6 m -63.29 -34.35 66.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.34 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -56.46 -51.2 69.33 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.621 -179.839 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 -65.11 -42.92 93.54 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.26 179.781 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.605 ' CD1' ' HB2' ' B' ' 220' ' ' ALA . 14.4 tp -60.16 -46.64 89.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.169 0.509 . . . . 0.0 110.275 -179.66 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 71.2 mt -63.86 -37.98 89.4 Favored 'General case' 0 C--O 1.221 -0.415 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.251 179.515 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 66.1 t0 -59.47 -44.46 93.01 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.315 -179.705 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.445 ' O ' ' CG ' ' A' ' 104' ' ' HIS . 15.5 mm-40 -64.71 -50.22 67.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.7 -179.988 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . 0.56 ' HB2' ' CD1' ' B' ' 216' ' ' LEU . . . -63.81 -40.45 96.66 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.415 -179.907 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 4.3 mm -63.75 -48.22 87.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.751 -179.037 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -67.11 -43.57 82.14 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.364 -179.71 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' HIS . . . . . 0.445 ' CG ' ' O ' ' A' ' 100' ' ' GLU . 58.1 m170 -62.76 -41.01 99.02 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.613 -179.422 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 23.3 t -76.21 -42.39 46.26 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.888 0.375 . . . . 0.0 110.923 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 85.0 tt0 -62.89 -28.8 70.29 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.547 -179.615 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 84.8 t60 . . . . . 0 C--N 1.331 -0.222 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.193 -179.073 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 135' ' ' ASP . . . . . 0.42 ' O ' ' OD1' ' B' ' 135' ' ' ASP . 67.7 t0 . . . . . 0 N--CA 1.464 0.269 0 CA-C-O 121.003 0.43 . . . . 0.0 110.668 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 57.4 p -45.55 -50.82 12.69 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.252 179.107 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -63.94 -42.52 97.3 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.074 179.681 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 138' ' ' ALA . . . . . 0.496 ' O ' HG23 ' B' ' 142' ' ' VAL . . . -56.74 -35.61 68.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.207 179.832 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -66.69 -52.83 40.21 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 179.37 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -61.48 -40.33 94.14 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.71 -179.676 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -61.79 -52.02 65.92 Favored 'General case' 0 C--O 1.242 0.665 0 CA-C-O 121.233 0.54 . . . . 0.0 110.53 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 142' ' ' VAL . . . . . 0.496 HG23 ' O ' ' B' ' 138' ' ' ALA . 90.3 t -62.18 -46.12 97.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.024 179.611 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -52.89 -43.26 66.04 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 120.86 0.362 . . . . 0.0 110.256 179.693 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 11.6 t -59.47 -43.34 93.26 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.006 179.782 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 26.7 m -62.87 -50.98 68.78 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 120.586 -0.446 . . . . 0.0 110.589 179.466 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 146' ' ' LEU . . . . . 0.45 ' N ' ' CD1' ' B' ' 146' ' ' LEU . 7.7 mp -65.86 -20.56 66.28 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.69 -0.232 . . . . 0.0 110.773 179.643 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 147' ' ' GLN . . . . . 0.531 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 59.3 tt0 -74.51 -59.79 2.57 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.604 179.434 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -60.43 -55.05 38.24 Favored 'General case' 0 CA--C 1.522 -0.117 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.8 -179.263 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 149' ' ' LEU . . . . . 0.514 HD13 HD13 ' B' ' 158' ' ' LEU . 3.9 mm? -47.62 -29.53 3.0 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.239 -179.341 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 150' ' ' ALA . . . . . 0.531 ' HB3' ' O ' ' B' ' 147' ' ' GLN . . . -59.33 -143.51 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.203 0.525 . . . . 0.0 110.308 179.422 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 151' ' ' THR . . . . . . . . . . . . . 2.6 m 61.67 116.06 0.02 OUTLIER Pre-proline 0 C--N 1.322 -0.602 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.167 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_exo -48.4 -52.0 9.2 Favored 'Trans proline' 0 C--N 1.31 -1.496 0 C-N-CA 122.319 2.013 . . . . 0.0 113.364 -179.011 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 78.0 p -54.64 -48.4 72.31 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.027 -178.43 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 82.3 mtp180 -67.17 -37.73 84.22 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 120.853 -0.339 . . . . 0.0 110.588 -179.824 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 155' ' ' LEU . . . . . 0.518 ' O ' HD13 ' B' ' 155' ' ' LEU . 0.2 OUTLIER -60.73 -53.39 57.95 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 120.431 -0.508 . . . . 0.0 110.802 -178.491 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 156' ' ' MET . . . . . 0.568 ' SD ' HD11 ' B' ' 175' ' ' ILE . 4.5 ttt -61.06 -47.14 87.71 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.782 -179.851 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 96.1 mt -61.47 -44.56 98.77 Favored 'Isoleucine or valine' 0 C--O 1.243 0.749 0 CA-C-O 121.399 0.618 . . . . 0.0 110.356 -179.574 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 158' ' ' LEU . . . . . 0.514 HD13 HD13 ' B' ' 149' ' ' LEU . 33.7 mt -61.89 -40.13 94.35 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.151 179.901 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 16.2 m -60.47 -41.53 94.34 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.055 -0.521 . . . . 0.0 109.829 179.386 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 68.2 tp60 -57.06 -46.86 82.13 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.918 179.943 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 161' ' ' LEU . . . . . 0.421 HD23 ' HA ' ' B' ' 161' ' ' LEU . 32.6 mt -66.26 -38.6 88.22 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.836 179.376 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 162' ' ' ARG . . . . . 0.41 HH12 HG13 ' B' ' 221' ' ' ILE . 55.9 ttp180 -55.12 -43.76 74.39 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.226 -178.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -134.67 64.59 1.59 Allowed 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.948 0.404 . . . . 0.0 110.204 179.704 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . 173.8 77.58 0.05 OUTLIER Glycine 0 CA--C 1.531 1.037 0 N-CA-C 110.774 -0.931 . . . . 0.0 110.774 -179.762 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -75.35 106.4 2.26 Favored 'Trans proline' 0 N--CA 1.494 1.536 0 C-N-CA 122.547 2.165 . . . . 0.0 111.677 -179.541 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 166' ' ' LEU . . . . . 0.537 ' O ' HD12 ' B' ' 166' ' ' LEU . 0.3 OUTLIER -158.41 154.45 23.58 Favored Pre-proline 0 C--N 1.325 -0.5 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.425 -179.342 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -64.6 176.89 2.51 Favored 'Trans proline' 0 C--N 1.309 -1.52 0 C-N-CA 122.834 2.356 . . . . 0.0 112.218 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 168' ' ' VAL . . . . . 0.571 HG23 ' N ' ' B' ' 169' ' ' THR . 4.3 m -67.51 -45.52 85.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.885 -179.815 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 169' ' ' THR . . . . . 0.571 ' N ' HG23 ' B' ' 168' ' ' VAL . 0.0 OUTLIER -57.63 -41.35 81.17 Favored 'General case' 0 C--O 1.246 0.9 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.349 -179.632 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 38.0 t0 -72.67 -37.81 67.81 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.527 178.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 8.6 tt -64.39 -38.41 90.92 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.171 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 172' ' ' ALA . . . . . . . . . . . . . . . -63.81 -45.31 90.2 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.264 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -60.91 -42.37 97.93 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.342 -0.543 . . . . 0.0 110.292 179.67 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -67.7 -52.28 39.61 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.927 -179.463 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 175' ' ' ILE . . . . . 0.695 ' O ' HG23 ' B' ' 175' ' ' ILE . 4.8 tt -174.57 85.7 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.771 -179.745 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . -168.71 -61.38 0.03 OUTLIER Glycine 0 C--N 1.315 -0.596 0 N-CA-C 110.527 -1.029 . . . . 0.0 110.527 178.532 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 64.5 mtm 56.17 29.61 15.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.792 0.329 . . . . 0.0 110.492 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 178' ' ' GLU . . . . . 0.525 ' O ' ' N ' ' B' ' 180' ' ' SER . 20.8 pt-20 -163.19 39.93 0.1 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.625 -179.816 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 179' ' ' GLN . . . . . 0.406 ' HG2' ' H ' ' B' ' 179' ' ' GLN . 1.1 pt20 -40.75 -22.4 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.561 179.738 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 180' ' ' SER . . . . . 0.525 ' N ' ' O ' ' B' ' 178' ' ' GLU . 77.3 p -68.41 -42.68 78.65 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.383 179.686 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 181' ' ' ALA . . . . . 0.478 ' N ' ' O ' ' B' ' 178' ' ' GLU . . . -66.16 -35.56 80.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.348 179.556 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 99.0 t -66.96 -48.07 80.53 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.643 179.884 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 69.6 m -60.02 -43.44 95.27 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.841 0.353 . . . . 0.0 110.517 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 184' ' ' HIS . . . . . 0.512 ' ND1' ' O ' ' B' ' 180' ' ' SER . 33.8 m80 -63.37 -50.27 70.56 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-O 121.155 0.502 . . . . 0.0 110.739 -179.817 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 -63.62 -36.83 85.11 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.41 179.667 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 5.6 tt -62.47 -44.51 96.23 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.548 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 19.0 mmm180 -62.73 -42.15 99.52 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.863 0.363 . . . . 0.0 110.412 -179.833 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 71.5 t -62.13 -55.5 23.68 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 C-N-CA 119.989 -0.684 . . . . 0.0 110.066 -179.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 83.8 mt -60.67 -34.78 74.83 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.809 -0.441 . . . . 0.0 109.809 -179.629 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 76.3 ttt180 -58.13 -42.12 85.15 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.43 179.783 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -60.42 -46.47 89.91 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.582 -0.447 . . . . 0.0 110.445 -179.867 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 192' ' ' LEU . . . . . 0.538 ' N ' HD22 ' B' ' 192' ' ' LEU . 3.9 mm? -66.97 -41.69 86.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.658 179.56 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 109.14 93.38 2.27 Favored Glycine 0 CA--C 1.522 0.471 0 N-CA-C 110.85 -0.9 . . . . 0.0 110.85 -179.631 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 52.3 tp -158.83 -25.27 0.08 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.845 0.355 . . . . 0.0 110.542 179.491 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 24.1 m -137.95 159.82 33.35 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.346 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.407 179.85 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 196' ' ' VAL . . . . . 0.519 HG12 ' N ' ' B' ' 197' ' ' GLY . 73.8 t -145.35 159.16 13.13 Favored 'Isoleucine or valine' 0 C--O 1.232 0.137 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.361 -179.873 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 197' ' ' GLY . . . . . 0.519 ' N ' HG12 ' B' ' 196' ' ' VAL . . . -125.97 143.41 14.41 Favored Glycine 0 N--CA 1.463 0.45 0 N-CA-C 110.463 -1.055 . . . . 0.0 110.463 179.34 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 95.1 m-20 . . . . . 0 CA--C 1.514 -0.406 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 -179.57 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 62.2 t . . . . . 0 N--CA 1.463 0.213 0 CA-C-O 120.841 0.353 . . . . 0.0 110.63 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 46.5 m-85 -100.8 132.63 46.1 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.205 178.886 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 43.2 t -150.97 171.12 17.79 Favored 'General case' 0 C--O 1.231 0.093 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.197 -179.741 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . 41.7 mt -70.59 150.84 45.65 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.384 -179.576 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -53.85 -51.76 62.55 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.657 -0.417 . . . . 0.0 110.462 -179.63 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -138.87 -174.86 3.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.273 -179.372 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 68.2 p -92.6 7.99 40.96 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.451 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 212' ' ' HIS . . . . . . . . . . . . . 18.8 t-160 -51.11 -68.38 0.17 Allowed 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.039 0.447 . . . . 0.0 110.47 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 25.1 m -62.9 -32.87 57.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.295 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 214' ' ' ALA . . . . . . . . . . . . . . . -58.05 -50.37 73.68 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.594 -179.812 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -65.59 -43.17 90.54 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.212 179.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 216' ' ' LEU . . . . . 0.56 ' CD1' ' HB2' ' A' ' 101' ' ' ALA . 15.1 tp -60.24 -46.1 90.96 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.339 -179.526 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 79.3 mt -64.13 -38.55 91.46 Favored 'General case' 0 C--O 1.221 -0.406 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.332 179.373 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 63.9 t0 -59.45 -45.01 92.81 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.477 -179.879 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 219' ' ' GLU . . . . . 0.434 ' O ' ' CG ' ' B' ' 223' ' ' HIS . 15.8 mm-40 -64.23 -49.94 69.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.531 -179.921 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 220' ' ' ALA . . . . . 0.605 ' HB2' ' CD1' ' A' ' 97' ' ' LEU . . . -63.9 -40.97 97.73 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.328 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 221' ' ' ILE . . . . . 0.41 HG13 HH12 ' B' ' 162' ' ' ARG . 3.7 mm -63.45 -49.11 84.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 C-N-CA 120.639 -0.424 . . . . 0.0 110.764 -179.004 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -65.52 -44.56 86.55 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.836 0.351 . . . . 0.0 110.321 -179.799 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 223' ' ' HIS . . . . . 0.434 ' CG ' ' O ' ' B' ' 219' ' ' GLU . 62.3 m170 -61.81 -41.58 97.94 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.584 -179.485 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 5.5 t -75.07 -42.59 56.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.864 0.364 . . . . 0.0 111.153 179.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 80.0 tt0 -63.48 -26.86 68.91 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.462 -179.426 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 85.4 t60 . . . . . 0 C--N 1.331 -0.199 0 C-N-CA 120.721 -0.391 . . . . 0.0 110.054 -179.032 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.31 0 N-CA-C 109.494 -1.442 . . . . 0.0 109.494 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 23.5 m-70 -66.5 -39.03 88.49 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.784 0.326 . . . . 0.0 110.525 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 83.77 177.45 51.6 Favored Glycine 0 CA--C 1.523 0.552 0 N-CA-C 110.656 -0.978 . . . . 0.0 110.656 -179.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 27.1 m -135.66 161.97 37.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 120.742 0.306 . . . . 0.0 110.278 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -129.53 -19.17 3.44 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.465 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 61.61 -134.83 47.37 Favored Glycine 0 CA--C 1.524 0.61 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 89.9 mtm180 -74.31 144.44 44.52 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.701 0.286 . . . . 0.0 110.389 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.541 ' H ' HD22 ' A' ' 9' ' ' ASN . 0.1 OUTLIER -144.05 45.65 1.45 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.621 -179.95 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.446 ' N ' ' CD ' ' A' ' 11' ' ' PRO . 82.3 mtt85 54.5 53.59 10.11 Favored Pre-proline 0 C--N 1.331 -0.2 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.514 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.446 ' CD ' ' N ' ' A' ' 10' ' ' ARG . 36.8 Cg_endo -65.66 137.66 50.91 Favored 'Trans proline' 0 C--N 1.308 -1.599 0 C-N-CA 122.747 2.298 . . . . 0.0 111.855 -179.557 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 38.1 t -173.49 171.93 3.8 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.675 179.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 49.2 68.8 3.16 Favored Pre-proline 0 CA--C 1.53 0.205 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.565 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -71.4 160.35 48.9 Favored 'Trans proline' 0 C--N 1.31 -1.463 0 C-N-CA 122.764 2.309 . . . . 0.0 111.927 -179.632 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 76.0 mt -69.04 165.45 20.18 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.24 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 38.1 m-20 -97.75 -51.49 4.08 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.36 0.6 . . . . 0.0 111.088 179.293 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 96.7 p -55.88 -28.39 56.39 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.254 -179.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -70.91 -49.85 41.28 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.645 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.435 ' O ' HG23 ' A' ' 23' ' ' VAL . . . -55.34 -41.29 72.29 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 -179.741 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.8 -53.81 48.51 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 120.493 -0.483 . . . . 0.0 110.317 179.408 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.06 -47.73 80.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.9 0.381 . . . . 0.0 110.995 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 18.5 mm100 -56.58 -51.14 69.75 Favored 'General case' 0 C--O 1.24 0.604 0 CA-C-O 121.304 0.573 . . . . 0.0 110.488 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.435 HG23 ' O ' ' A' ' 19' ' ' ALA . 71.0 t -60.97 -43.12 95.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.814 179.674 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.485 ' HB2' HD12 ' B' ' 155' ' ' LEU . . . -50.83 -47.66 60.04 Favored 'General case' 0 C--O 1.223 -0.317 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.422 179.682 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 39.3 t -60.43 -43.15 97.08 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.084 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 21.7 m -63.34 -50.73 68.85 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.549 -0.46 . . . . 0.0 110.937 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 89.9 mt -70.13 -22.07 63.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.783 -179.487 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.488 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 55.3 tt0 -75.81 -55.1 5.96 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.661 178.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.48 -55.29 35.21 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 120.616 -0.434 . . . . 0.0 110.396 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.476 ' O ' ' O ' ' A' ' 31' ' ' ALA . 86.3 mt -45.99 -32.61 2.86 Favored 'General case' 0 CA--C 1.513 -0.447 0 C-N-CA 121.052 -0.259 . . . . 0.0 110.346 -179.202 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.488 ' HB3' ' O ' ' A' ' 28' ' ' GLN . . . -58.08 -126.84 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.282 179.575 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.512 ' HG1' ' HB3' ' A' ' 35' ' ' ARG . 0.6 OUTLIER 54.04 108.22 0.02 OUTLIER Pre-proline 0 CA--C 1.539 0.52 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.482 -179.721 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -48.77 -58.22 1.88 Allowed 'Trans proline' 0 N--CA 1.496 1.639 0 C-N-CA 122.265 1.977 . . . . 0.0 113.257 -179.752 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 5.4 t -57.26 -45.4 84.03 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.823 -178.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.512 ' HB3' ' HG1' ' A' ' 32' ' ' THR . 42.6 ttm180 -57.38 -44.05 84.12 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 120.806 -0.358 . . . . 0.0 110.778 -179.513 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.445 HD12 ' HB2' ' B' ' 143' ' ' ALA . 10.0 mt -62.64 -44.5 96.12 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.833 -0.347 . . . . 0.0 110.638 179.632 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 6.9 ttt -54.08 -48.77 70.31 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 120.371 -0.532 . . . . 0.0 110.222 179.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 47.8 mm -64.87 -43.03 96.37 Favored 'Isoleucine or valine' 0 C--O 1.236 0.39 0 CA-C-O 121.302 0.572 . . . . 0.0 110.528 179.387 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.614 ' O ' HD23 ' A' ' 39' ' ' LEU . 1.8 tt -61.6 -43.96 97.88 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.15 -179.308 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 12.0 m -59.26 -43.22 92.48 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.913 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 57.4 tp60 -55.56 -50.09 70.98 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.541 HD13 ' O ' ' A' ' 42' ' ' LEU . 0.2 OUTLIER -64.58 -42.92 95.3 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.96 0.886 . . . . 0.0 110.255 -179.498 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.51 ' O ' ' NE ' ' A' ' 43' ' ' ARG . 0.0 OUTLIER -45.11 -35.79 3.31 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.389 -178.886 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 89.1 m-20 -61.29 -40.99 96.19 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.274 -179.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 167.1 170.9 32.55 Favored Glycine 0 CA--C 1.528 0.87 0 C-N-CA 120.549 -0.834 . . . . 0.0 111.25 178.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -62.6 150.49 87.59 Favored 'Trans proline' 0 N--CA 1.493 1.5 0 C-N-CA 122.733 2.289 . . . . 0.0 112.174 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 2.0 pp -175.14 145.03 0.85 Allowed Pre-proline 0 N--CA 1.449 -0.485 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.712 178.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -72.31 168.53 23.95 Favored 'Trans proline' 0 N--CA 1.498 1.742 0 C-N-CA 122.748 2.299 . . . . 0.0 112.28 178.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.5 HG23 ' N ' ' A' ' 50' ' ' THR . 9.0 m -63.26 -41.41 92.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.819 0.818 . . . . 0.0 110.603 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.5 ' N ' HG23 ' A' ' 49' ' ' VAL . 10.8 m -55.35 -41.01 71.95 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 114.756 -1.111 . . . . 0.0 110.479 179.538 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 89.2 m-20 -72.2 -42.92 65.26 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.086 0.47 . . . . 0.0 110.76 179.036 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.548 HD23 ' O ' ' A' ' 52' ' ' LEU . 1.1 tt -61.65 -36.14 79.94 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.088 -0.505 . . . . 0.0 109.91 -179.2 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.548 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -68.61 -48.51 63.92 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 116.175 -0.466 . . . . 0.0 109.854 179.818 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -53.15 -39.65 63.7 Favored 'General case' 0 C--O 1.232 0.166 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.392 179.529 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.47 -40.42 95.67 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.563 179.569 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 97.6 mt -89.89 -69.7 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.519 -0.227 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.362 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . 0.548 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 150.49 74.88 0.01 OUTLIER Glycine 0 CA--C 1.523 0.56 0 C-N-CA 120.869 -0.681 . . . . 0.0 111.677 179.421 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 34.2 ttm 61.27 77.01 0.35 Allowed 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.823 0.344 . . . . 0.0 110.968 179.036 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 88.1 mt-10 -150.29 21.57 0.84 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.694 179.653 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -60.44 -29.8 69.24 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.632 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 77.9 p -70.32 -45.91 65.27 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.641 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.415 ' O ' ' OE1' ' A' ' 66' ' ' GLN . . . -63.11 -32.06 73.35 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.926 179.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 77.1 t -69.18 -48.13 70.46 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.131 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.518 179.458 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 78.2 p -57.75 -41.88 82.82 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.642 -0.423 . . . . 0.0 110.424 -179.728 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . 0.432 ' O ' HG23 ' A' ' 69' ' ' VAL . 52.1 m80 -67.93 -43.67 78.61 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.945 179.606 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.485 ' N ' ' OE1' ' A' ' 66' ' ' GLN . 0.7 OUTLIER -59.48 -51.62 69.09 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.022 0.439 . . . . 0.0 110.389 -179.242 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -61.51 -40.11 93.42 Favored 'General case' 0 CA--C 1.505 -0.761 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.267 -179.612 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -57.61 -44.84 85.77 Favored 'General case' 0 C--N 1.307 -1.28 0 CA-C-O 121.417 0.627 . . . . 0.0 110.446 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.432 HG23 ' O ' ' A' ' 65' ' ' HIS . 90.3 t -62.29 -53.97 40.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 C-N-CA 120.248 -0.581 . . . . 0.0 110.012 -179.775 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.456 ' O ' ' O ' ' A' ' 74' ' ' GLY . 4.2 mm? -61.51 -31.74 71.76 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.093 0.473 . . . . 0.0 110.242 -179.791 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.715 HH12 ' H ' ' A' ' 78' ' ' GLY . 59.9 ttt85 -59.29 -41.83 89.86 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.262 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 99.2 m-20 -63.72 -37.43 87.33 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.159 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.445 HD23 ' N ' ' A' ' 73' ' ' LEU . 5.8 mt -89.42 -7.08 55.89 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.458 -179.487 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . 0.596 ' C ' ' H ' ' A' ' 76' ' ' VAL . . . 89.56 -140.92 15.87 Favored Glycine 0 CA--C 1.521 0.43 0 N-CA-C 110.357 -1.097 . . . . 0.0 110.357 -179.814 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 38.2 mt 67.29 -29.47 0.15 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.727 0.298 . . . . 0.0 110.528 -179.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.596 ' H ' ' C ' ' A' ' 74' ' ' GLY . 3.3 m -134.34 156.67 40.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.148 179.486 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 54.7 t -137.7 146.99 26.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.367 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.715 ' H ' HH12 ' A' ' 71' ' ' ARG . . . -121.47 140.92 14.25 Favored Glycine 0 C--N 1.335 0.514 0 N-CA-C 110.161 -1.176 . . . . 0.0 110.161 179.162 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 99.9 m-20 -114.37 106.43 14.3 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.9 0.381 . . . . 0.0 110.384 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 62.5 ttp180 -71.85 133.49 45.5 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.297 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -143.48 94.5 2.61 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.463 179.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 57.96 -118.63 13.64 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 110.921 -0.872 . . . . 0.0 110.921 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 17.5 ptp180 -99.04 29.67 3.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.793 0.33 . . . . 0.0 110.672 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 11.2 p -148.8 130.53 15.06 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.31 -179.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 1.1 tp -116.14 127.6 73.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 179.258 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 84.3 t -101.16 128.5 53.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.24 179.066 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.514 ' O ' HD21 ' A' ' 42' ' ' LEU . 80.7 m-85 -106.37 131.63 53.36 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.384 179.685 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 93.7 p -150.16 170.47 18.87 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-O 120.842 0.354 . . . . 0.0 110.191 -179.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.662 ' N ' HD22 ' A' ' 89' ' ' LEU . 3.5 mm? -72.31 148.02 45.79 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.537 -179.576 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 26.4 t80 -51.7 -47.46 63.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.187 -179.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.49 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 19.7 p-10 -153.49 179.19 9.03 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.703 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . 0.467 ' O ' ' HB3' ' A' ' 95' ' ' ALA . 81.3 p -76.57 -17.91 58.95 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.609 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . 0.435 ' CD2' ' C ' ' A' ' 93' ' ' HIS . 12.1 t-160 -38.83 -69.39 0.13 Allowed 'General case' 0 C--O 1.236 0.368 0 CA-C-O 121.015 0.436 . . . . 0.0 110.777 -179.884 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 83.0 t -51.59 -41.16 27.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.969 -179.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.467 ' HB3' ' O ' ' A' ' 92' ' ' THR . . . -56.85 -47.82 79.5 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.666 -179.931 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 99.0 mm-40 -58.21 -47.81 82.33 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.122 -179.612 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.514 ' CD1' ' HB2' ' B' ' 220' ' ' ALA . 15.4 tp -59.38 -43.66 92.87 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.048 -179.577 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 87.1 mt -63.7 -40.37 96.62 Favored 'General case' 0 C--O 1.221 -0.427 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.433 179.812 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -59.02 -42.78 91.02 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.622 -179.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.516 ' O ' ' ND1' ' A' ' 104' ' ' HIS . 72.6 mm-40 -67.2 -48.69 67.13 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.786 -0.366 . . . . 0.0 110.764 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.605 ' HB2' ' CD1' ' B' ' 216' ' ' LEU . . . -64.88 -50.57 66.07 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.159 -179.623 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.534 ' O ' HD13 ' A' ' 102' ' ' ILE . 0.3 OUTLIER -62.36 -45.93 97.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 C-N-CA 120.396 -0.522 . . . . 0.0 110.769 -178.687 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' TYR . . . . . 0.52 ' N ' ' CG2' ' A' ' 102' ' ' ILE . 75.3 t80 -63.01 -49.31 75.14 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.117 -178.678 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . 0.516 ' ND1' ' O ' ' A' ' 100' ' ' GLU . 23.6 m80 -63.34 -37.22 86.41 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.737 -179.84 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 5.0 t -74.95 -44.07 50.58 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.946 0.403 . . . . 0.0 111.261 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 10.2 tm-20 -69.39 -21.59 63.77 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.566 -179.636 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . 0.472 ' CE1' HD21 ' A' ' 108' ' ' LEU . 0.3 OUTLIER -52.24 -70.31 0.09 Allowed 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.344 -179.091 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.472 HD21 ' CE1' ' A' ' 107' ' ' HIS . 52.7 mt -118.79 -136.21 0.34 Allowed 'General case' 0 N--CA 1.462 0.154 0 N-CA-C 109.9 -0.407 . . . . 0.0 109.9 -179.805 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . 0.515 ' NE2' ' O ' ' A' ' 111' ' ' GLY . 78.6 t60 -157.67 65.76 0.48 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.675 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 73.0 mt -63.69 -42.81 97.95 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.622 -179.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . 0.515 ' O ' ' NE2' ' A' ' 109' ' ' HIS . . . -84.78 142.05 19.84 Favored Glycine 0 CA--C 1.522 0.522 0 N-CA-C 110.581 -1.008 . . . . 0.0 110.581 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -140.48 150.86 44.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.72 0.295 . . . . 0.0 110.284 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 48.3 t -136.6 91.4 2.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.459 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -72.92 142.4 47.86 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.507 179.842 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 95.7 mtt-85 -57.12 105.9 0.27 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.376 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 5.6 m-70 -72.92 149.87 90.19 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.799 -179.455 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -68.44 155.09 70.34 Favored 'Trans proline' 0 N--CA 1.493 1.456 0 C-N-CA 122.624 2.216 . . . . 0.0 112.167 179.516 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 79.7 p -60.61 -34.23 73.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.267 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -62.86 -37.64 87.68 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.484 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.756 0 CA-C-O 117.982 -1.455 . . . . 0.0 110.874 179.949 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.278 0 N-CA-C 109.463 -1.455 . . . . 0.0 109.463 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 35.0 m-70 -66.25 -39.63 89.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.779 0.323 . . . . 0.0 110.476 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 123' ' ' GLY . . . . . . . . . . . . . . . 84.36 178.9 51.52 Favored Glycine 0 CA--C 1.524 0.632 0 N-CA-C 110.725 -0.95 . . . . 0.0 110.725 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 35.8 m -135.37 163.4 35.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.762 0.315 . . . . 0.0 110.232 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 125' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -130.6 -19.88 2.97 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.533 -179.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 63.97 -133.07 40.18 Favored Glycine 0 CA--C 1.524 0.636 0 N-CA-C 110.865 -0.894 . . . . 0.0 110.865 179.8 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 127' ' ' ARG . . . . . . . . . . . . . 89.5 mtm180 -77.01 145.45 38.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.705 0.288 . . . . 0.0 110.548 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 128' ' ' ASN . . . . . 0.462 ' H ' HD22 ' B' ' 128' ' ' ASN . 0.1 OUTLIER -144.05 47.56 1.42 Allowed 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.582 179.993 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 129' ' ' ARG . . . . . 0.438 ' N ' ' CD ' ' B' ' 130' ' ' PRO . 82.4 mtt85 51.03 54.63 15.55 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.418 179.843 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 130' ' ' PRO . . . . . 0.438 ' CD ' ' N ' ' B' ' 129' ' ' ARG . 38.4 Cg_endo -66.61 137.76 47.24 Favored 'Trans proline' 0 N--CA 1.495 1.587 0 C-N-CA 122.681 2.254 . . . . 0.0 111.893 -179.741 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 48.2 t -173.29 169.98 4.37 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.581 179.679 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 132' ' ' ALA . . . . . . . . . . . . . . . 50.65 68.73 3.12 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.524 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 133' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -71.6 160.69 47.59 Favored 'Trans proline' 0 C--N 1.312 -1.387 0 C-N-CA 122.791 2.327 . . . . 0.0 111.919 -179.48 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 69.2 mt -67.63 165.02 17.91 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.351 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 36.3 m-20 -97.91 -50.81 4.28 Favored 'General case' 0 C--O 1.238 0.47 0 CA-C-O 121.283 0.563 . . . . 0.0 110.991 179.256 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 92.1 p -57.21 -28.72 63.13 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.333 -179.584 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 10.3 tp-100 -70.66 -49.59 45.68 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.66 179.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 138' ' ' ALA . . . . . 0.444 ' O ' HG23 ' B' ' 142' ' ' VAL . . . -55.69 -40.28 72.14 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 120.705 -0.398 . . . . 0.0 109.93 -179.614 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -63.07 -53.41 54.05 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 120.547 -0.461 . . . . 0.0 110.237 179.21 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -57.24 -47.5 81.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.867 0.365 . . . . 0.0 110.86 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 20.3 mm100 -55.99 -50.98 69.34 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-O 121.278 0.561 . . . . 0.0 110.452 -179.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 142' ' ' VAL . . . . . 0.444 HG23 ' O ' ' B' ' 138' ' ' ALA . 76.5 t -61.96 -42.95 96.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.864 179.734 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 143' ' ' ALA . . . . . 0.445 ' HB2' HD12 ' A' ' 36' ' ' LEU . . . -50.23 -48.6 54.4 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.269 179.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 38.1 t -60.42 -43.53 96.67 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.168 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 27.5 m -62.57 -50.48 71.13 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 120.556 -0.458 . . . . 0.0 111.026 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 91.3 mt -70.53 -21.6 62.71 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.901 -179.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 147' ' ' GLN . . . . . 0.469 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 58.3 tt0 -75.24 -56.98 4.18 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.561 179.144 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -59.65 -54.69 43.52 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.441 -179.454 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.487 ' O ' ' O ' ' B' ' 150' ' ' ALA . 81.0 mt -45.74 -34.5 3.65 Favored 'General case' 0 CA--C 1.514 -0.437 0 C-N-CA 120.976 -0.29 . . . . 0.0 110.455 -178.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 150' ' ' ALA . . . . . 0.487 ' O ' ' O ' ' B' ' 149' ' ' LEU . . . -57.57 -126.04 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.225 179.582 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 151' ' ' THR . . . . . 0.435 ' O ' ' O ' ' B' ' 150' ' ' ALA . 0.6 OUTLIER 54.35 108.22 0.02 OUTLIER Pre-proline 0 C--N 1.323 -0.579 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.49 -179.596 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_exo -48.26 -60.05 1.02 Allowed 'Trans proline' 0 N--CA 1.495 1.569 0 C-N-CA 122.256 1.97 . . . . 0.0 113.389 -179.769 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 39.8 t -56.64 -45.3 81.68 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.825 -178.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 154' ' ' ARG . . . . . 0.403 ' HB3' ' HG1' ' B' ' 151' ' ' THR . 42.0 ttm180 -57.17 -43.5 82.65 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 120.796 -0.362 . . . . 0.0 110.624 -179.583 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 155' ' ' LEU . . . . . 0.485 HD12 ' HB2' ' A' ' 24' ' ' ALA . 10.0 mt -63.1 -44.22 96.3 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.809 -0.357 . . . . 0.0 110.642 179.64 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 6.3 ttt -53.69 -48.76 69.22 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.358 -0.537 . . . . 0.0 110.158 179.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 41.8 mm -64.87 -43.43 96.33 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 CA-C-O 121.278 0.561 . . . . 0.0 110.524 179.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 158' ' ' LEU . . . . . 0.617 HD23 ' O ' ' B' ' 158' ' ' LEU . 1.7 tt -61.48 -43.5 98.76 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.064 -179.217 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 17.6 m -59.38 -43.51 92.88 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.033 -0.531 . . . . 0.0 109.996 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 61.3 tp60 -55.89 -49.97 71.93 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 120.483 -0.487 . . . . 0.0 109.811 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 161' ' ' LEU . . . . . 0.55 HD13 ' O ' ' B' ' 161' ' ' LEU . 0.2 OUTLIER -64.31 -41.83 96.63 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.733 0.778 . . . . 0.0 110.159 -179.454 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 162' ' ' ARG . . . . . 0.532 ' NE ' ' O ' ' B' ' 162' ' ' ARG . 0.0 OUTLIER -45.56 -36.4 4.63 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.261 -179.006 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -60.99 -41.64 96.89 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.214 -179.609 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . 167.61 171.85 34.05 Favored Glycine 0 CA--C 1.528 0.862 0 C-N-CA 120.582 -0.818 . . . . 0.0 111.341 178.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_exo -64.12 150.84 87.51 Favored 'Trans proline' 0 N--CA 1.494 1.508 0 C-N-CA 122.836 2.357 . . . . 0.0 112.215 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 1.8 pp -174.85 146.46 1.0 Allowed Pre-proline 0 C--N 1.326 -0.455 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.753 178.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -71.74 166.83 28.27 Favored 'Trans proline' 0 N--CA 1.495 1.614 0 C-N-CA 122.831 2.354 . . . . 0.0 112.316 178.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 168' ' ' VAL . . . . . 0.502 HG23 ' N ' ' B' ' 169' ' ' THR . 10.1 m -62.32 -40.9 89.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.83 0.824 . . . . 0.0 110.636 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 169' ' ' THR . . . . . 0.502 ' N ' HG23 ' B' ' 168' ' ' VAL . 7.4 m -56.83 -38.8 73.13 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 114.745 -1.116 . . . . 0.0 110.294 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 27.5 m-20 -71.7 -44.33 64.39 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.201 0.524 . . . . 0.0 110.335 179.346 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 171' ' ' LEU . . . . . 0.455 HD23 ' O ' ' B' ' 171' ' ' LEU . 0.7 OUTLIER -61.06 -32.54 72.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.16 -179.498 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 172' ' ' ALA . . . . . 0.541 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -70.99 -50.09 38.13 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.86 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -52.83 -38.82 61.86 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 120.515 -0.474 . . . . 0.0 110.336 179.607 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -64.76 -41.66 95.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.64 179.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 96.7 mt -89.4 -68.94 0.64 Allowed 'Isoleucine or valine' 0 CA--C 1.521 -0.139 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.329 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 176' ' ' GLY . . . . . 0.541 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 150.18 74.38 0.01 OUTLIER Glycine 0 CA--C 1.523 0.587 0 C-N-CA 120.959 -0.639 . . . . 0.0 111.633 179.373 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 33.4 ttm 61.38 78.15 0.3 Allowed 'General case' 0 C--O 1.232 0.148 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.866 179.293 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 88.2 mt-10 -150.56 23.09 0.8 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.628 179.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -61.78 -29.24 70.01 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.452 179.808 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 180' ' ' SER . . . . . 0.446 ' O ' ' ND1' ' B' ' 184' ' ' HIS . 78.3 p -70.28 -46.74 63.72 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.891 0.377 . . . . 0.0 110.463 -179.527 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 181' ' ' ALA . . . . . 0.409 ' O ' ' OE1' ' B' ' 185' ' ' GLN . . . -63.56 -30.97 72.01 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.931 179.691 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 54.2 t -69.34 -49.32 61.59 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.199 0 CA-C-O 121.135 0.493 . . . . 0.0 110.688 179.464 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 78.9 p -58.56 -40.61 83.53 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.653 -0.419 . . . . 0.0 110.463 -179.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 184' ' ' HIS . . . . . 0.446 ' ND1' ' O ' ' B' ' 180' ' ' SER . 51.4 m80 -67.92 -43.18 79.8 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.983 179.703 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 185' ' ' GLN . . . . . 0.476 ' N ' ' OE1' ' B' ' 185' ' ' GLN . 0.7 OUTLIER -60.49 -51.37 69.74 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.038 0.447 . . . . 0.0 110.491 -179.247 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -61.59 -39.65 91.97 Favored 'General case' 0 CA--C 1.506 -0.748 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.007 -179.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 15.1 tpt180 -57.91 -45.19 86.86 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-O 121.495 0.664 . . . . 0.0 110.46 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 73.9 t -62.21 -53.67 44.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 C-N-CA 120.159 -0.617 . . . . 0.0 109.96 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 189' ' ' LEU . . . . . 0.455 ' O ' ' O ' ' B' ' 193' ' ' GLY . 4.3 mm? -61.04 -31.88 71.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.09 0.472 . . . . 0.0 110.155 -179.751 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 190' ' ' ARG . . . . . 0.803 HH12 ' H ' ' B' ' 197' ' ' GLY . 60.4 ttt85 -59.61 -41.97 91.58 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.331 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 -63.57 -37.02 85.75 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 120.734 -0.386 . . . . 0.0 110.346 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 192' ' ' LEU . . . . . 0.454 ' N ' HD23 ' B' ' 192' ' ' LEU . 5.7 mt -89.56 -8.78 51.97 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.612 -179.364 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 193' ' ' GLY . . . . . 0.604 ' C ' ' H ' ' B' ' 195' ' ' VAL . . . 91.8 -141.72 15.75 Favored Glycine 0 CA--C 1.52 0.365 0 N-CA-C 110.389 -1.084 . . . . 0.0 110.389 -179.787 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 30.6 mt 67.86 -29.82 0.16 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.759 0.314 . . . . 0.0 110.613 -179.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 195' ' ' VAL . . . . . 0.604 ' H ' ' C ' ' B' ' 193' ' ' GLY . 3.1 m -136.18 158.34 38.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.29 179.735 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 196' ' ' VAL . . . . . . . . . . . . . 77.5 t -140.99 153.7 20.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.318 179.257 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 197' ' ' GLY . . . . . 0.803 ' H ' HH12 ' B' ' 190' ' ' ARG . . . -126.04 144.17 14.92 Favored Glycine 0 N--CA 1.464 0.505 0 N-CA-C 110.362 -1.095 . . . . 0.0 110.362 179.614 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 33.9 m-20 -114.48 109.16 17.87 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 120.89 0.376 . . . . 0.0 110.614 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 61.6 ttp180 -74.17 132.64 42.4 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.447 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 200' ' ' ALA . . . . . . . . . . . . . . . -142.24 95.44 2.8 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.689 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 201' ' ' GLY . . . . . . . . . . . . . . . 57.38 -115.48 6.72 Favored Glycine 0 CA--C 1.524 0.646 0 N-CA-C 110.712 -0.955 . . . . 0.0 110.712 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 202' ' ' ARG . . . . . . . . . . . . . 17.6 ptp180 -102.61 30.82 4.42 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.764 0.316 . . . . 0.0 110.592 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 10.2 p -148.44 130.68 15.54 Favored 'General case' 0 CA--C 1.516 -0.341 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.196 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 1.5 tp -116.65 125.65 73.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.76 179.674 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 96.6 t -100.11 129.09 51.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.151 179.267 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 206' ' ' TYR . . . . . 0.439 ' O ' HD21 ' B' ' 161' ' ' LEU . 85.7 m-85 -106.92 132.52 52.78 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.418 179.716 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 51.5 p -151.36 171.36 17.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.281 -179.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 208' ' ' LEU . . . . . 0.682 HD22 ' N ' ' B' ' 208' ' ' LEU . 3.5 mm? -73.62 148.52 42.78 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.814 -179.692 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 23.4 t80 -51.63 -47.81 63.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.271 -179.806 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 210' ' ' ASP . . . . . 0.518 ' N ' ' OD1' ' B' ' 210' ' ' ASP . 14.3 p-10 -153.07 -179.46 7.71 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.809 0.338 . . . . 0.0 110.655 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 211' ' ' THR . . . . . 0.466 ' O ' ' HB3' ' B' ' 214' ' ' ALA . 65.1 p -77.81 -16.94 57.97 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.531 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 212' ' ' HIS . . . . . 0.412 ' NE2' ' CB ' ' A' ' 104' ' ' HIS . 11.9 t-160 -39.4 -69.63 0.12 Allowed 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.079 0.466 . . . . 0.0 110.831 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 87.0 t -50.75 -41.56 21.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.924 -179.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 214' ' ' ALA . . . . . 0.466 ' HB3' ' O ' ' B' ' 211' ' ' THR . . . -57.34 -47.2 82.19 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.918 0.389 . . . . 0.0 110.813 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -57.98 -47.39 83.13 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.138 -179.538 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 216' ' ' LEU . . . . . 0.605 ' CD1' ' HB2' ' A' ' 101' ' ' ALA . 14.1 tp -60.62 -43.56 97.36 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 120.449 -0.501 . . . . 0.0 110.049 -179.64 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 86.6 mt -63.56 -39.94 95.68 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.439 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -59.66 -42.08 92.02 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.487 -179.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 219' ' ' GLU . . . . . 0.459 ' O ' ' ND1' ' B' ' 223' ' ' HIS . 70.8 mm-40 -67.72 -49.2 63.86 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.796 -0.361 . . . . 0.0 110.742 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 220' ' ' ALA . . . . . 0.514 ' HB2' ' CD1' ' A' ' 97' ' ' LEU . . . -63.89 -51.3 65.16 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.986 -179.667 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 221' ' ' ILE . . . . . 0.553 HD13 ' O ' ' B' ' 221' ' ' ILE . 0.2 OUTLIER -62.26 -45.91 97.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 C-N-CA 120.419 -0.512 . . . . 0.0 110.667 -178.587 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 222' ' ' TYR . . . . . 0.508 ' N ' ' CG2' ' B' ' 221' ' ' ILE . 77.1 t80 -62.52 -49.29 75.95 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.06 -178.489 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 223' ' ' HIS . . . . . 0.459 ' ND1' ' O ' ' B' ' 219' ' ' GLU . 23.8 m80 -63.76 -36.54 84.21 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.737 -179.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 5.6 t -75.04 -44.66 46.5 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.927 0.394 . . . . 0.0 111.354 179.792 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 11.5 tm-20 -69.58 -21.67 63.59 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.596 -179.598 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 226' ' ' HIS . . . . . 0.406 ' CE1' HD21 ' B' ' 227' ' ' LEU . 0.4 OUTLIER -52.03 -70.17 0.09 Allowed 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 120.581 -0.448 . . . . 0.0 110.458 -179.145 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 227' ' ' LEU . . . . . 0.406 HD21 ' CE1' ' B' ' 226' ' ' HIS . 52.9 mt -118.5 -134.08 0.33 Allowed 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 228' ' ' HIS . . . . . 0.508 ' NE2' ' O ' ' B' ' 230' ' ' GLY . 77.5 t60 -160.39 65.05 0.33 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.619 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 229' ' ' LEU . . . . . . . . . . . . . 73.1 mt -63.4 -42.19 98.77 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.765 -179.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 230' ' ' GLY . . . . . 0.508 ' O ' ' NE2' ' B' ' 228' ' ' HIS . . . -84.93 140.42 18.59 Favored Glycine 0 CA--C 1.523 0.555 0 N-CA-C 110.674 -0.97 . . . . 0.0 110.674 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 231' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -137.16 153.08 50.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.739 0.304 . . . . 0.0 110.246 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 232' ' ' SER . . . . . . . . . . . . . 45.6 t -139.11 89.16 2.33 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.582 -179.847 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 233' ' ' ASP . . . . . . . . . . . . . 97.1 m-20 -71.67 144.6 49.31 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.365 179.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 234' ' ' ARG . . . . . . . . . . . . . 95.7 mtt-85 -59.88 104.58 0.31 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.586 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 235' ' ' HIS . . . . . . . . . . . . . 4.5 m-70 -70.81 149.42 95.11 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.786 -179.394 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 236' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -67.99 154.4 72.82 Favored 'Trans proline' 0 N--CA 1.494 1.504 0 C-N-CA 122.619 2.213 . . . . 0.0 112.142 179.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 237' ' ' SER . . . . . . . . . . . . . 78.3 p -59.67 -34.18 72.52 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.271 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 238' ' ' ALA . . . . . . . . . . . . . . . -63.56 -38.48 91.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.617 179.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.726 0 CA-C-O 118.09 -1.394 . . . . 0.0 110.914 -179.958 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.297 0 N-CA-C 109.387 -1.485 . . . . 0.0 109.387 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 -130.3 141.2 50.61 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.856 0.36 . . . . 0.0 110.511 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 79.88 18.6 72.24 Favored Glycine 0 CA--C 1.521 0.411 0 N-CA-C 111.01 -0.836 . . . . 0.0 111.01 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.449 HG22 ' H ' ' A' ' 7' ' ' GLY . 11.8 p -125.87 135.14 64.81 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 CA-C-O 120.897 0.38 . . . . 0.0 110.545 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -63.73 -39.31 93.97 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.466 -179.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . 0.449 ' H ' HG22 ' A' ' 5' ' ' VAL . . . 131.71 95.65 0.66 Allowed Glycine 0 N--CA 1.465 0.6 0 N-CA-C 110.797 -0.921 . . . . 0.0 110.797 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 85.1 mtt85 48.65 80.83 0.06 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.823 0.344 . . . . 0.0 110.496 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 85.7 m-20 -72.63 140.09 47.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.515 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 58.4 ttm-85 46.24 75.81 0.62 Allowed Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.537 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -58.17 141.76 96.77 Favored 'Trans proline' 0 C--N 1.305 -1.743 0 C-N-CA 122.639 2.226 . . . . 0.0 112.055 -179.817 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.8 p -82.08 172.27 13.41 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.663 179.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.615 ' H ' ' CD ' ' A' ' 14' ' ' PRO . . . -173.45 -44.77 0.0 OUTLIER Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.418 179.888 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.615 ' CD ' ' H ' ' A' ' 13' ' ' ALA . 39.3 Cg_exo -61.06 135.9 61.86 Favored 'Trans proline' 0 C--N 1.309 -1.542 0 C-N-CA 122.659 2.239 . . . . 0.0 111.735 -179.41 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.515 ' N ' HD23 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -102.19 -56.29 2.29 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.221 -179.628 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.46 ' C ' ' O ' ' A' ' 15' ' ' LEU . 9.0 m-20 -32.34 -56.69 0.33 Allowed 'General case' 0 C--O 1.234 0.245 0 O-C-N 123.359 0.412 . . . . 0.0 110.927 -178.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 11.9 t -58.22 -50.01 75.08 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.818 179.439 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.562 ' NE2' ' O ' ' A' ' 14' ' ' PRO . 75.4 mt-30 -61.41 -43.13 99.4 Favored 'General case' 0 C--O 1.221 -0.407 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.393 179.787 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -55.3 -41.33 72.2 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.296 -179.714 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.05 -54.8 21.29 Favored 'General case' 0 C--N 1.333 -0.126 0 C-N-CA 120.672 -0.411 . . . . 0.0 110.835 179.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -58.58 -50.52 73.51 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.933 179.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.415 ' OE1' ' OG ' ' B' ' 224' ' ' SER . 54.5 tt0 -53.63 -50.69 65.15 Favored 'General case' 0 C--O 1.244 0.767 0 CA-C-O 121.061 0.458 . . . . 0.0 110.502 -179.766 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.432 ' O ' ' OG1' ' A' ' 26' ' ' THR . 49.1 t -61.5 -43.62 97.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.071 -0.513 . . . . 0.0 109.818 179.271 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.417 ' HB2' HD12 ' B' ' 155' ' ' LEU . . . -53.49 -47.24 70.0 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.308 -179.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 41.1 t -58.71 -43.66 90.17 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.508 -179.275 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.432 ' OG1' ' O ' ' A' ' 23' ' ' VAL . 12.7 p -65.45 -53.81 37.47 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 120.602 -0.439 . . . . 0.0 111.216 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.433 ' N ' ' CD1' ' A' ' 27' ' ' LEU . 8.0 mp -65.44 -23.13 66.86 Favored 'General case' 0 C--O 1.222 -0.39 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.941 -179.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.474 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 46.6 tt0 -73.11 -63.8 1.1 Allowed 'General case' 0 C--N 1.32 -0.682 0 O-C-N 123.39 0.431 . . . . 0.0 110.588 -179.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -54.94 -52.45 62.94 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.905 -179.111 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.405 ' O ' ' C ' ' A' ' 31' ' ' ALA . 4.1 mm? -53.44 -40.0 64.84 Favored 'General case' 0 CA--C 1.512 -0.516 0 C-N-CA 120.701 -0.399 . . . . 0.0 110.917 -179.636 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.587 ' O ' ' C ' ' A' ' 32' ' ' THR . . . -38.76 -73.1 0.05 Allowed 'General case' 0 CA--C 1.51 -0.59 0 O-C-N 123.637 0.585 . . . . 0.0 110.309 179.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.587 ' C ' ' O ' ' A' ' 31' ' ' ALA . 6.0 p -4.53 110.99 0.03 OUTLIER Pre-proline 0 CA--C 1.54 0.56 0 O-C-N 124.294 0.996 . . . . 0.0 111.134 179.241 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_exo -50.11 -45.52 32.81 Favored 'Trans proline' 0 C--N 1.303 -1.843 0 C-N-CA 122.231 1.954 . . . . 0.0 112.45 -177.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 66.7 m -56.98 -44.82 83.05 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.982 -179.105 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 77.6 mmt-85 -63.31 -38.32 90.7 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.063 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.424 ' CD1' ' O ' ' A' ' 31' ' ' ALA . 93.9 mt -64.66 -54.2 35.49 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.682 -0.407 . . . . 0.0 111.14 -179.614 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 10.7 tpt -54.34 -49.44 69.73 Favored 'General case' 0 C--O 1.239 0.539 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.394 -179.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 5.3 mm -62.77 -44.19 99.32 Favored 'Isoleucine or valine' 0 C--O 1.243 0.742 0 CA-C-O 121.22 0.533 . . . . 0.0 110.832 179.619 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 27.1 mt -61.41 -39.23 89.97 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.165 179.602 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 18.9 m -58.83 -40.37 83.99 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 179.554 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -60.55 -44.54 96.03 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 121.072 0.463 . . . . 0.0 110.077 179.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.511 HD21 HD13 ' A' ' 47' ' ' LEU . 13.8 mt -63.45 -37.94 89.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.746 179.158 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.425 ' C ' ' O ' ' A' ' 42' ' ' LEU . 77.4 ttt-85 -35.76 -30.04 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.482 -178.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.497 ' N ' ' O ' ' A' ' 42' ' ' LEU . 98.8 m-20 -65.34 -48.69 72.13 Favored 'General case' 0 C--N 1.334 -0.092 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.803 179.476 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.493 ' N ' ' O ' ' A' ' 42' ' ' LEU . . . 152.45 -79.52 0.2 Allowed Glycine 0 CA--C 1.528 0.863 0 N-CA-C 110.717 -0.953 . . . . 0.0 110.717 179.827 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -70.21 -172.88 0.67 Allowed 'Trans proline' 0 C--N 1.306 -1.692 0 C-N-CA 122.699 2.266 . . . . 0.0 111.937 179.513 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.511 HD13 HD21 ' A' ' 42' ' ' LEU . 6.8 tp -140.24 70.14 33.82 Favored Pre-proline 0 N--CA 1.454 -0.249 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.21 179.061 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_exo -62.42 91.73 0.13 Allowed 'Trans proline' 0 C--N 1.303 -1.839 0 C-N-CA 122.816 2.344 . . . . 0.0 110.973 177.442 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 55.0 t -55.91 -53.18 41.06 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 C-N-CA 120.639 -0.424 . . . . 0.0 111.62 -179.019 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.476 ' O ' ' OE1' ' A' ' 54' ' ' GLU . 29.0 p -63.07 -63.32 1.23 Allowed 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 120.894 0.378 . . . . 0.0 110.917 179.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.436 ' N ' ' OG1' ' A' ' 50' ' ' THR . 0.3 OUTLIER -46.14 -47.13 17.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.325 -178.723 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 68.1 mt -62.71 -38.62 91.16 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.582 179.184 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.431 ' HB3' ' O ' ' A' ' 50' ' ' THR . . . -54.13 -50.98 65.69 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.494 179.716 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.476 ' OE1' ' O ' ' A' ' 50' ' ' THR . 7.7 mp0 -63.77 -38.44 91.11 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.357 179.78 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.445 ' O ' HG23 ' A' ' 56' ' ' ILE . . . -57.21 -61.37 2.51 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 120.365 -0.534 . . . . 0.0 111.326 -179.125 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.445 HG23 ' O ' ' A' ' 55' ' ' ALA . 15.0 pt -156.89 -10.28 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.731 -179.772 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -61.23 -55.43 29.39 Favored Glycine 0 C--N 1.335 0.526 0 N-CA-C 110.924 -0.87 . . . . 0.0 110.924 -178.727 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 78.9 mtp 45.55 25.82 0.27 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.684 0.278 . . . . 0.0 110.475 179.341 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.531 ' HG2' ' H ' ' A' ' 62' ' ' ALA . 73.2 tt0 -171.73 84.5 0.08 Allowed 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 109.77 -0.455 . . . . 0.0 109.77 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -63.7 -30.38 71.49 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.249 -179.204 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 35.5 t -64.14 -36.3 83.59 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.503 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.531 ' H ' ' HG2' ' A' ' 59' ' ' GLU . . . -67.71 -33.59 75.2 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.657 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 73.6 t -73.06 -52.84 20.42 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.919 -179.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 77.4 p -58.7 -44.58 90.38 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.316 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -62.78 -50.42 71.11 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.545 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 32.5 tt0 -60.9 -39.71 90.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.395 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 48.8 tp -61.12 -43.42 98.9 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.331 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -61.51 -40.59 95.17 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.403 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 97.9 t -61.7 -54.67 31.69 Favored 'Isoleucine or valine' 0 N--CA 1.46 0.069 0 C-N-CA 120.208 -0.597 . . . . 0.0 110.398 -179.479 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 10.9 mp -61.84 -33.79 74.79 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 179.612 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 26.2 tpt85 -58.4 -41.91 85.98 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.356 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 99.8 m-20 -60.72 -44.15 96.97 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.238 -179.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.407 ' HG ' ' H ' ' A' ' 73' ' ' LEU . 10.3 mt -63.87 -40.16 95.89 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.223 -179.801 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 103.94 19.27 12.07 Favored Glycine 0 CA--C 1.522 0.529 0 N-CA-C 110.869 -0.893 . . . . 0.0 110.869 -179.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.3 tp -80.54 -6.01 57.59 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.034 0.445 . . . . 0.0 110.694 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 34.6 m -139.27 163.26 26.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.298 -179.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.591 HG12 ' N ' ' A' ' 78' ' ' GLY . 77.7 t -149.49 164.43 3.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.789 179.867 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.591 ' N ' HG12 ' A' ' 77' ' ' VAL . . . -107.65 147.05 16.32 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 110.445 -1.062 . . . . 0.0 110.445 179.374 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -130.67 137.54 49.62 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 120.762 0.315 . . . . 0.0 110.771 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.416 ' CD ' ' N ' ' A' ' 80' ' ' ARG . 1.1 mpt_? -74.66 131.81 41.2 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.215 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.487 ' O ' ' N ' ' A' ' 83' ' ' ARG . . . -135.59 91.62 2.74 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.186 179.063 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.451 ' C ' ' O ' ' A' ' 81' ' ' ALA . . . 29.8 -91.38 0.01 OUTLIER Glycine 0 C--N 1.338 0.679 0 N-CA-C 111.872 -0.491 . . . . 0.0 111.872 179.307 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.487 ' N ' ' O ' ' A' ' 81' ' ' ALA . 85.2 mtp180 -41.99 -63.9 0.67 Allowed 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.948 -0.301 . . . . 0.0 111.311 179.762 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 67.9 m -155.84 179.93 8.74 Favored 'General case' 0 C--O 1.221 -0.408 0 CA-C-O 121.062 0.458 . . . . 0.0 110.459 -178.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.576 ' C ' HD12 ' A' ' 85' ' ' ILE . 1.1 pp -88.71 152.8 3.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.072 -179.62 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.501 ' N ' HD12 ' A' ' 85' ' ' ILE . 29.3 m -128.77 161.44 37.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.605 179.561 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 78.4 m-85 -98.09 131.99 44.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.3 -179.429 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 66.0 p -145.49 166.74 24.8 Favored 'General case' 0 C--O 1.224 -0.243 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.142 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 44.8 mt -65.79 145.0 56.51 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.556 -179.607 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 12.7 t80 -50.47 -47.09 57.19 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.403 -179.511 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 23.6 p30 -141.69 169.73 17.04 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.861 0.362 . . . . 0.0 110.454 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . 0.514 ' O ' ' HB3' ' A' ' 95' ' ' ALA . 0.0 OUTLIER -85.71 -16.88 37.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.476 -179.756 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 -45.43 -65.02 0.6 Allowed 'General case' 0 C--O 1.237 0.429 0 CA-C-O 120.984 0.421 . . . . 0.0 110.589 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.419 HG13 ' N ' ' A' ' 95' ' ' ALA . 12.5 p -48.0 -36.63 5.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.303 -179.821 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.514 ' HB3' ' O ' ' A' ' 92' ' ' THR . . . -64.35 -37.64 88.24 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.241 179.452 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 66.5 tp60 -62.51 -47.28 84.65 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-O 121.275 0.56 . . . . 0.0 109.935 -179.595 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.61 HD21 ' HA ' ' B' ' 220' ' ' ALA . 7.1 mp -61.56 -42.75 99.3 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 120.424 -0.511 . . . . 0.0 110.214 -179.473 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 93.8 mt -66.97 -35.25 79.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.267 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 36.3 m-20 -60.78 -42.39 97.43 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.29 -0.413 . . . . 0.0 109.993 -179.408 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.497 ' C ' ' HD1' ' A' ' 104' ' ' HIS . 82.7 mt-10 -70.43 -52.81 19.56 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.383 179.197 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.594 ' HA ' HD21 ' B' ' 216' ' ' LEU . . . -55.44 -45.81 76.79 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.627 179.563 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 5.1 mm -63.57 -44.92 98.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.87 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 89.6 t80 -63.96 -47.02 82.09 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.145 0.497 . . . . 0.0 110.61 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . 0.497 ' HD1' ' C ' ' A' ' 100' ' ' GLU . 51.8 m80 -60.62 -36.09 77.76 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.472 -179.735 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.421 ' OG ' ' OE1' ' B' ' 141' ' ' GLN . 38.9 t -76.52 -46.88 24.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.873 179.562 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -55.59 -28.21 53.77 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.359 -179.635 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 52.8 t-80 -79.57 -2.56 42.99 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.685 179.708 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 57.1 tp -154.43 104.81 2.6 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.446 179.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -173.7 43.47 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.586 179.523 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.556 ' N ' HD12 ' A' ' 110' ' ' LEU . 10.4 mp -62.64 -42.18 99.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.314 -179.646 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 146.38 95.72 0.18 Allowed Glycine 0 N--CA 1.461 0.333 0 N-CA-C 110.88 -0.888 . . . . 0.0 110.88 -179.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 49.5 tp -129.95 129.97 44.48 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.831 0.348 . . . . 0.0 110.634 179.719 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 11.7 t -60.63 -43.89 96.99 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.61 179.556 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . 0.434 ' O ' ' N ' ' A' ' 116' ' ' HIS . 52.3 t0 44.6 72.06 0.22 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.562 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 10.1 tpp85 -56.01 88.01 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.586 -179.701 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . 0.627 ' N ' ' CD ' ' A' ' 117' ' ' PRO . 0.1 OUTLIER -94.34 -42.79 0.3 Allowed Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.38 179.409 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . 0.627 ' CD ' ' N ' ' A' ' 116' ' ' HIS . 23.6 Cg_exo -63.49 146.44 92.98 Favored 'Trans proline' 0 C--N 1.304 -1.81 0 C-N-CA 122.643 2.229 . . . . 0.0 111.726 -179.719 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 8.5 m -145.2 -30.09 0.43 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.558 179.383 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -70.61 144.6 51.12 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.613 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.686 0 CA-C-O 117.967 -1.463 . . . . 0.0 110.877 -179.925 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.223 0 N-CA-C 109.363 -1.495 . . . . 0.0 109.363 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 -128.04 143.19 51.06 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 120.976 0.417 . . . . 0.0 110.459 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 123' ' ' GLY . . . . . . . . . . . . . . . 78.55 19.61 73.34 Favored Glycine 0 CA--C 1.52 0.38 0 N-CA-C 110.995 -0.842 . . . . 0.0 110.995 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 124' ' ' VAL . . . . . 0.408 HG22 ' H ' ' B' ' 126' ' ' GLY . 14.7 p -126.99 135.32 63.99 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 CA-C-O 120.897 0.379 . . . . 0.0 110.47 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 125' ' ' GLU . . . . . . . . . . . . . 72.2 mm-40 -63.69 -40.37 96.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.458 -179.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . 0.408 ' H ' HG22 ' B' ' 124' ' ' VAL . . . 132.35 94.2 0.58 Allowed Glycine 0 N--CA 1.464 0.551 0 N-CA-C 110.91 -0.876 . . . . 0.0 110.91 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 127' ' ' ARG . . . . . . . . . . . . . 85.4 mtt85 50.17 80.42 0.07 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.864 0.364 . . . . 0.0 110.592 179.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 128' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -72.8 140.87 47.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.439 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 129' ' ' ARG . . . . . . . . . . . . . 57.8 ttm-85 44.7 75.05 0.69 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.084 0.469 . . . . 0.0 110.499 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -59.26 145.3 98.23 Favored 'Trans proline' 0 C--N 1.305 -1.746 0 C-N-CA 122.68 2.253 . . . . 0.0 112.11 -179.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 13.2 p -81.53 176.21 9.87 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.478 179.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 132' ' ' ALA . . . . . 0.594 ' H ' ' HD2' ' B' ' 133' ' ' PRO . . . -176.18 -44.83 0.0 OUTLIER Pre-proline 0 C--N 1.325 -0.479 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.615 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 133' ' ' PRO . . . . . 0.594 ' HD2' ' H ' ' B' ' 132' ' ' ALA . 31.8 Cg_exo -58.42 140.71 95.65 Favored 'Trans proline' 0 C--N 1.308 -1.601 0 C-N-CA 122.593 2.195 . . . . 0.0 111.747 -178.732 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -116.39 10.57 14.72 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.347 179.875 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -95.44 -59.56 1.85 Allowed 'General case' 0 C--O 1.238 0.476 0 CA-C-O 121.279 0.561 . . . . 0.0 110.591 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 11.4 t -59.26 -41.35 88.59 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.248 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 137' ' ' GLN . . . . . 0.539 ' NE2' ' O ' ' B' ' 133' ' ' PRO . 77.1 mt-30 -64.86 -46.28 82.51 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.44 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 138' ' ' ALA . . . . . . . . . . . . . . . -54.5 -41.56 69.75 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.183 -179.665 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -66.14 -54.3 27.17 Favored 'General case' 0 N--CA 1.457 -0.112 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.897 179.476 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -58.38 -51.27 70.54 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.976 179.594 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 141' ' ' GLN . . . . . 0.421 ' OE1' ' OG ' ' A' ' 105' ' ' SER . 57.1 tt0 -53.43 -49.86 66.44 Favored 'General case' 0 C--O 1.243 0.762 0 CA-C-O 121.084 0.469 . . . . 0.0 110.385 -179.747 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 142' ' ' VAL . . . . . . . . . . . . . 51.2 t -61.66 -43.25 96.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.699 179.186 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -54.44 -46.52 73.28 Favored 'General case' 0 C--O 1.217 -0.62 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.307 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 40.0 t -59.01 -44.01 91.64 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.508 -179.256 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 18.0 p -65.51 -53.8 37.26 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 120.619 -0.432 . . . . 0.0 111.216 179.875 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 146' ' ' LEU . . . . . 0.415 ' N ' ' CD1' ' B' ' 146' ' ' LEU . 8.2 mp -65.04 -23.11 67.09 Favored 'General case' 0 C--O 1.22 -0.453 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.016 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 147' ' ' GLN . . . . . 0.485 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 46.5 tt0 -73.66 -63.35 1.22 Allowed 'General case' 0 C--N 1.319 -0.741 0 O-C-N 123.364 0.415 . . . . 0.0 110.498 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -55.19 -52.92 61.8 Favored 'General case' 0 CA--C 1.521 -0.153 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.01 -179.085 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.411 ' O ' ' C ' ' B' ' 150' ' ' ALA . 4.1 mm? -52.96 -39.87 63.27 Favored 'General case' 0 CA--C 1.514 -0.429 0 C-N-CA 120.661 -0.415 . . . . 0.0 110.943 -179.773 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 150' ' ' ALA . . . . . 0.58 ' O ' ' C ' ' B' ' 151' ' ' THR . . . -39.19 -72.87 0.05 Allowed 'General case' 0 CA--C 1.511 -0.557 0 O-C-N 123.649 0.593 . . . . 0.0 110.285 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 151' ' ' THR . . . . . 0.58 ' C ' ' O ' ' B' ' 150' ' ' ALA . 6.8 p -4.77 110.3 0.03 OUTLIER Pre-proline 0 CA--C 1.54 0.582 0 O-C-N 124.279 0.987 . . . . 0.0 111.097 179.292 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_exo -49.4 -45.08 32.05 Favored 'Trans proline' 0 C--N 1.302 -1.875 0 C-N-CA 122.192 1.928 . . . . 0.0 112.487 -177.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 53.5 m -57.3 -44.85 84.45 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.983 -179.128 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 154' ' ' ARG . . . . . 0.621 ' NH1' HE21 ' B' ' 185' ' ' GLN . 77.2 mmt-85 -63.16 -39.01 93.42 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.996 -179.704 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 155' ' ' LEU . . . . . 0.417 HD12 ' HB2' ' A' ' 24' ' ' ALA . 94.4 mt -63.86 -54.41 35.27 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 120.733 -0.387 . . . . 0.0 111.102 -179.559 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 10.8 tpt -54.48 -49.65 69.61 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.489 -0.484 . . . . 0.0 110.461 -179.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 5.0 mm -62.21 -44.36 99.01 Favored 'Isoleucine or valine' 0 C--O 1.242 0.686 0 CA-C-O 121.328 0.585 . . . . 0.0 110.764 179.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 27.5 mt -61.81 -39.32 91.33 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.109 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 99.8 m -58.5 -40.64 83.39 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 179.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -60.73 -44.24 96.9 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 120.968 0.414 . . . . 0.0 109.927 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 161' ' ' LEU . . . . . 0.534 HD21 HD13 ' B' ' 166' ' ' LEU . 14.2 mt -63.72 -36.31 83.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.852 179.219 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 162' ' ' ARG . . . . . 0.421 ' C ' ' O ' ' B' ' 161' ' ' LEU . 77.4 ttt-85 -36.48 -30.63 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.471 -179.104 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 163' ' ' ASN . . . . . 0.476 ' N ' ' O ' ' B' ' 161' ' ' LEU . 96.4 m-20 -64.96 -50.25 67.15 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.834 179.81 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 164' ' ' GLY . . . . . 0.449 ' N ' ' O ' ' B' ' 161' ' ' LEU . . . 153.91 -78.01 0.2 Allowed Glycine 0 CA--C 1.528 0.891 0 N-CA-C 110.682 -0.967 . . . . 0.0 110.682 179.715 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -70.71 -171.43 0.55 Allowed 'Trans proline' 0 C--N 1.306 -1.709 0 C-N-CA 122.681 2.254 . . . . 0.0 111.96 179.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 166' ' ' LEU . . . . . 0.534 HD13 HD21 ' B' ' 161' ' ' LEU . 8.7 tp -142.25 69.9 22.34 Favored Pre-proline 0 C--N 1.331 -0.217 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.084 179.208 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_exo -63.02 91.83 0.14 Allowed 'Trans proline' 0 C--N 1.303 -1.863 0 C-N-CA 122.903 2.402 . . . . 0.0 111.123 177.774 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . 71.0 t -55.47 -53.29 37.62 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 C-N-CA 120.629 -0.429 . . . . 0.0 111.788 -178.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 169' ' ' THR . . . . . 0.476 ' O ' ' OE1' ' B' ' 173' ' ' GLU . 23.5 p -63.01 -63.1 1.3 Allowed 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.16 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 170' ' ' ASP . . . . . 0.442 ' N ' ' OG1' ' B' ' 169' ' ' THR . 0.8 OUTLIER -48.02 -44.97 31.44 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.159 -0.473 . . . . 0.0 109.966 -177.96 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 64.5 mt -63.52 -39.79 95.36 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.681 178.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 172' ' ' ALA . . . . . 0.409 ' HB3' ' O ' ' B' ' 169' ' ' THR . . . -53.31 -50.57 64.66 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.355 179.557 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 173' ' ' GLU . . . . . 0.476 ' OE1' ' O ' ' B' ' 169' ' ' THR . 8.7 mp0 -63.51 -38.86 92.77 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.382 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 174' ' ' ALA . . . . . 0.452 ' O ' HG23 ' B' ' 175' ' ' ILE . . . -56.76 -61.86 2.14 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 120.364 -0.534 . . . . 0.0 111.23 -179.077 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 175' ' ' ILE . . . . . 0.452 HG23 ' O ' ' B' ' 174' ' ' ALA . 15.5 pt -156.63 -9.76 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.752 -179.786 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . -61.51 -55.12 30.7 Favored Glycine 0 CA--C 1.521 0.467 0 N-CA-C 110.94 -0.864 . . . . 0.0 110.94 -178.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 76.5 mtp 45.43 26.37 0.29 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.706 0.288 . . . . 0.0 110.402 179.193 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 178' ' ' GLU . . . . . 0.471 ' HG2' ' H ' ' B' ' 181' ' ' ALA . 70.2 tt0 -172.6 85.34 0.06 Allowed 'General case' 0 CA--C 1.528 0.103 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -179.91 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -64.21 -29.84 70.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.289 -179.252 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 38.4 t -64.07 -37.74 88.54 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.534 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 181' ' ' ALA . . . . . 0.471 ' H ' ' HG2' ' B' ' 178' ' ' GLU . . . -66.71 -33.27 75.26 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.683 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 74.8 t -73.36 -53.05 19.22 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.15 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.866 -179.693 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 78.0 p -59.34 -44.03 92.7 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 -179.777 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 58.9 t-80 -63.9 -50.38 68.97 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-O 120.935 0.398 . . . . 0.0 110.653 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 185' ' ' GLN . . . . . 0.621 HE21 ' NH1' ' B' ' 154' ' ' ARG . 40.4 tt0 -61.27 -39.83 91.85 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.106 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 53.6 tp -60.92 -45.14 95.84 Favored 'General case' 0 C--O 1.222 -0.372 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.305 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -59.79 -41.66 91.67 Favored 'General case' 0 C--O 1.241 0.646 0 O-C-N 123.212 0.32 . . . . 0.0 110.415 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 88.1 t -59.26 -54.05 39.64 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.096 0 C-N-CA 120.241 -0.583 . . . . 0.0 110.076 -179.357 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 10.8 mp -62.13 -33.05 73.76 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.927 -0.398 . . . . 0.0 109.927 179.503 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -57.76 -41.41 81.88 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.26 -179.411 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -63.1 -40.48 97.77 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.425 -179.58 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 192' ' ' LEU . . . . . 0.412 ' N ' HD23 ' B' ' 192' ' ' LEU . 9.1 mt -66.27 -40.12 89.9 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.469 -179.489 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 103.44 17.13 18.41 Favored Glycine 0 CA--C 1.523 0.561 0 N-CA-C 110.923 -0.871 . . . . 0.0 110.923 -179.587 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 4.5 tp -80.24 -6.16 57.4 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.965 0.412 . . . . 0.0 110.656 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 34.3 m -138.67 162.5 29.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.33 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 196' ' ' VAL . . . . . 0.607 HG12 ' N ' ' B' ' 197' ' ' GLY . 71.3 t -149.28 164.16 4.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 120.905 0.384 . . . . 0.0 110.787 179.777 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 197' ' ' GLY . . . . . 0.607 ' N ' HG12 ' B' ' 196' ' ' VAL . . . -106.92 147.47 16.22 Favored Glycine 0 CA--C 1.523 0.575 0 N-CA-C 110.428 -1.069 . . . . 0.0 110.428 179.413 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 96.7 m-20 -130.72 139.08 50.26 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 120.742 0.306 . . . . 0.0 110.579 -179.791 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 16.3 mmt85 -77.38 134.76 38.36 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.374 -179.677 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 200' ' ' ALA . . . . . 0.494 ' O ' ' N ' ' B' ' 202' ' ' ARG . . . -139.22 90.8 2.45 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.262 179.412 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 201' ' ' GLY . . . . . 0.447 ' C ' ' O ' ' B' ' 200' ' ' ALA . . . 29.66 -90.84 0.01 OUTLIER Glycine 0 CA--C 1.524 0.636 0 O-C-N 123.649 0.593 . . . . 0.0 111.772 179.232 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 202' ' ' ARG . . . . . 0.494 ' N ' ' O ' ' B' ' 200' ' ' ALA . 85.0 mtp180 -41.52 -63.62 0.68 Allowed 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 121.012 -0.275 . . . . 0.0 111.382 179.568 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 70.1 m -157.01 179.64 9.11 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.226 0.536 . . . . 0.0 110.435 -179.125 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 204' ' ' ILE . . . . . 0.604 ' C ' HD12 ' B' ' 204' ' ' ILE . 1.1 pp -88.86 153.16 3.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.128 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 205' ' ' VAL . . . . . 0.505 ' N ' HD12 ' B' ' 204' ' ' ILE . 27.4 m -128.81 161.04 38.71 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.341 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.507 179.605 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 78.0 m-85 -97.58 131.18 44.41 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.229 -179.476 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 14.8 p -144.57 165.94 26.58 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.337 -179.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . 34.4 mt -65.51 146.01 55.39 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.485 -179.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 13.2 t80 -50.95 -48.46 60.93 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.337 -179.532 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 22.3 p30 -140.89 169.66 17.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.947 0.403 . . . . 0.0 110.441 -179.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 211' ' ' THR . . . . . 0.544 ' O ' ' HB3' ' B' ' 214' ' ' ALA . 0.1 OUTLIER -85.31 -17.28 37.31 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.384 -179.867 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 212' ' ' HIS . . . . . . . . . . . . . 85.3 m-70 -44.47 -65.49 0.51 Allowed 'General case' 0 C--O 1.237 0.412 0 CA-C-O 121.03 0.443 . . . . 0.0 110.569 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 11.4 p -48.28 -35.44 5.71 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.283 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 214' ' ' ALA . . . . . 0.544 ' HB3' ' O ' ' B' ' 211' ' ' THR . . . -64.79 -38.27 90.4 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.228 179.351 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 69.2 tp60 -62.21 -46.75 87.51 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 121.202 0.525 . . . . 0.0 110.021 -179.556 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 216' ' ' LEU . . . . . 0.594 HD21 ' HA ' ' A' ' 101' ' ' ALA . 6.8 mp -61.7 -43.54 98.67 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 120.437 -0.505 . . . . 0.0 110.239 -179.409 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 217' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' B' ' 217' ' ' LEU . 95.7 mt -66.1 -36.2 82.53 Favored 'General case' 0 C--O 1.222 -0.347 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.286 179.17 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 89.0 m-20 -59.76 -43.01 94.5 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.094 -179.434 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 219' ' ' GLU . . . . . 0.507 ' O ' ' ND1' ' B' ' 223' ' ' HIS . 96.7 mt-10 -69.57 -52.53 25.38 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.413 179.231 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 220' ' ' ALA . . . . . 0.61 ' HA ' HD21 ' A' ' 97' ' ' LEU . . . -56.5 -45.53 80.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.663 179.724 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 5.1 mm -63.27 -45.17 99.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.761 -179.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 91.0 t80 -63.91 -46.96 82.47 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.155 0.502 . . . . 0.0 110.676 179.646 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 223' ' ' HIS . . . . . 0.507 ' ND1' ' O ' ' B' ' 219' ' ' GLU . 46.2 m80 -60.36 -36.44 78.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.468 -179.623 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 224' ' ' SER . . . . . 0.415 ' OG ' ' OE1' ' A' ' 22' ' ' GLN . 10.2 t -76.36 -46.61 26.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.926 0.393 . . . . 0.0 110.836 179.643 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -55.44 -28.87 56.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.326 -179.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 55.6 t-80 -79.61 -2.68 43.67 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.695 179.7 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 227' ' ' LEU . . . . . . . . . . . . . 56.6 tp -153.5 104.18 2.72 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.606 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 228' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -173.4 44.97 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.52 179.525 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 229' ' ' LEU . . . . . 0.535 ' N ' HD12 ' B' ' 229' ' ' LEU . 10.7 mp -62.93 -42.37 99.78 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.466 -179.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . 145.3 93.75 0.16 Allowed Glycine 0 N--CA 1.46 0.292 0 N-CA-C 110.869 -0.892 . . . . 0.0 110.869 -179.813 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 231' ' ' LEU . . . . . . . . . . . . . 45.4 tp -127.84 129.95 47.81 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.84 0.352 . . . . 0.0 110.673 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 232' ' ' SER . . . . . . . . . . . . . 11.8 t -61.13 -43.54 98.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.593 179.593 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 233' ' ' ASP . . . . . 0.412 ' O ' ' N ' ' B' ' 235' ' ' HIS . 53.5 t0 43.57 78.89 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.774 -179.861 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 234' ' ' ARG . . . . . . . . . . . . . 10.4 tpp85 -60.68 85.52 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 121.074 0.464 . . . . 0.0 110.362 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 235' ' ' HIS . . . . . 0.609 ' N ' ' CD ' ' B' ' 236' ' ' PRO . 0.1 OUTLIER -90.46 -43.23 0.4 Allowed Pre-proline 0 C--N 1.325 -0.472 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.049 179.169 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 236' ' ' PRO . . . . . 0.609 ' CD ' ' N ' ' B' ' 235' ' ' HIS . 57.2 Cg_endo -79.72 144.09 17.17 Favored 'Trans proline' 0 C--N 1.309 -1.518 0 C-N-CA 122.641 2.227 . . . . 0.0 111.828 -178.715 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 237' ' ' SER . . . . . . . . . . . . . 4.0 m -141.74 -22.08 0.73 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.709 179.423 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 238' ' ' ALA . . . . . . . . . . . . . . . -66.82 141.73 57.59 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.576 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.219 -0.799 0 CA-C-O 118.028 -1.429 . . . . 0.0 110.93 179.996 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.268 0 N-CA-C 109.559 -1.416 . . . . 0.0 109.559 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 88.8 m-70 -66.51 -40.05 89.01 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.829 0.347 . . . . 0.0 110.577 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -166.96 114.63 0.59 Allowed Glycine 0 CA--C 1.525 0.666 0 N-CA-C 110.692 -0.963 . . . . 0.0 110.692 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 26.8 m -134.9 162.78 38.03 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.145 0 CA-C-O 120.848 0.356 . . . . 0.0 110.268 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.484 ' CD ' ' N ' ' A' ' 6' ' ' GLU . 1.2 pm0 -133.23 132.39 41.42 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.253 -179.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -92.41 46.6 2.59 Favored Glycine 0 CA--C 1.523 0.573 0 N-CA-C 110.798 -0.921 . . . . 0.0 110.798 179.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 78.7 ttt-85 -64.66 135.11 55.55 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.715 0.293 . . . . 0.0 110.401 -179.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 6.8 m120 -80.42 165.41 22.24 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.563 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 57.4 mtt180 62.04 62.07 2.35 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.523 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -77.11 46.74 2.03 Favored 'Trans proline' 0 C--N 1.31 -1.483 0 C-N-CA 122.812 2.342 . . . . 0.0 112.015 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 23.8 m -70.37 145.61 51.02 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.336 179.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -160.03 72.31 3.11 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.365 179.83 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_exo -60.51 144.15 99.5 Favored 'Trans proline' 0 C--N 1.308 -1.572 0 C-N-CA 122.977 2.451 . . . . 0.0 111.727 179.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.402 ' C ' HD12 ' A' ' 15' ' ' LEU . 0.3 OUTLIER -99.92 20.57 14.08 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.088 179.904 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 90.3 m-20 -94.82 -62.04 1.39 Allowed 'General case' 0 C--O 1.236 0.353 0 CA-C-O 121.123 0.487 . . . . 0.0 110.96 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 88.5 p -61.56 -37.51 84.08 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.347 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -66.17 -47.22 74.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.336 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.657 ' O ' HG23 ' A' ' 23' ' ' VAL . . . -56.24 -39.76 73.05 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.701 -0.4 . . . . 0.0 110.211 -179.753 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.565 ' HB1' ' HB3' ' B' ' 155' ' ' LEU . . . -64.04 -54.05 40.34 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.54 -0.464 . . . . 0.0 110.336 179.454 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -58.6 -47.93 82.68 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.29 -179.594 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -62.09 -50.97 69.81 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.984 -179.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.657 HG23 ' O ' ' A' ' 19' ' ' ALA . 95.1 t -61.25 -44.52 98.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.31 -179.699 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.1 -41.13 82.86 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.198 179.559 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 69.2 m -59.64 -43.64 93.79 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.137 179.616 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 85.7 m -62.91 -47.82 81.62 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.624 -0.43 . . . . 0.0 110.757 179.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 91.6 mt -67.82 -21.47 65.21 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.501 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.465 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 55.9 tt0 -75.33 -56.48 4.67 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.618 179.457 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.434 ' HB1' HH22 ' A' ' 35' ' ' ARG . . . -59.48 -53.9 52.78 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.614 -179.661 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.488 ' O ' ' O ' ' A' ' 31' ' ' ALA . 87.9 mt -47.13 -35.48 7.26 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 120.756 0.312 . . . . 0.0 110.196 -179.09 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.488 ' O ' ' O ' ' A' ' 30' ' ' LEU . . . -57.89 -140.35 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.44 179.103 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.432 ' O ' ' O ' ' A' ' 31' ' ' ALA . 47.2 m 57.65 112.75 0.02 OUTLIER Pre-proline 0 CA--C 1.54 0.574 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.98 -179.726 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . 0.419 ' O ' ' N ' ' A' ' 36' ' ' LEU . 51.3 Cg_exo -48.25 -59.07 1.38 Allowed 'Trans proline' 0 N--CA 1.495 1.617 0 C-N-CA 122.211 1.94 . . . . 0.0 113.306 -179.099 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 81.1 p -44.74 -48.36 10.78 Favored 'General case' 0 C--O 1.237 0.445 0 CA-C-O 121.18 0.514 . . . . 0.0 111.014 -178.66 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.434 HH22 ' HB1' ' A' ' 29' ' ' ALA . 84.2 mtp180 -72.46 -24.61 61.22 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.344 179.764 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.544 ' HB3' ' HB1' ' B' ' 139' ' ' ALA . 0.2 OUTLIER -67.2 -55.41 14.22 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 119.901 -0.72 . . . . 0.0 111.337 -178.542 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.417 ' HG2' ' H ' ' A' ' 37' ' ' MET . 5.2 ptp -64.78 -43.76 92.18 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.255 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 97.5 mt -63.12 -45.31 98.96 Favored 'Isoleucine or valine' 0 C--O 1.241 0.63 0 CA-C-O 121.415 0.626 . . . . 0.0 110.477 -179.313 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 5.3 tt -63.21 -41.23 99.11 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.599 179.72 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 31.7 m -59.26 -43.07 92.46 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.077 179.716 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 17.3 mm100 -56.85 -45.32 82.49 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.545 -0.462 . . . . 0.0 110.019 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.413 ' HA ' HD23 ' A' ' 42' ' ' LEU . 31.7 mt -66.5 -40.08 89.05 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.509 -0.477 . . . . 0.0 110.979 179.006 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 73.8 ttp85 -60.24 -34.2 73.35 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.682 -179.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -57.15 -40.11 76.55 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.262 -179.559 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 167.45 170.54 32.4 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 111.052 -0.819 . . . . 0.0 111.052 179.752 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -65.6 144.08 77.39 Favored 'Trans proline' 0 C--N 1.307 -1.624 0 C-N-CA 122.779 2.319 . . . . 0.0 111.809 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 1.9 pp -175.09 146.65 0.96 Allowed Pre-proline 0 C--N 1.325 -0.47 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.869 179.785 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -72.17 167.39 26.95 Favored 'Trans proline' 0 N--CA 1.495 1.566 0 C-N-CA 122.821 2.347 . . . . 0.0 112.19 179.333 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.431 ' CG2' ' N ' ' A' ' 50' ' ' THR . 3.1 m -62.38 -38.41 81.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 121.494 0.664 . . . . 0.0 110.425 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.431 ' N ' ' CG2' ' A' ' 49' ' ' VAL . 73.9 m -58.67 -44.65 90.24 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 114.526 -1.216 . . . . 0.0 110.293 179.781 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.422 ' O ' ' OD1' ' A' ' 51' ' ' ASP . 64.8 t0 -68.21 -37.2 80.63 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.923 -0.581 . . . . 0.0 109.907 178.579 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.672 HD13 ' C ' ' A' ' 52' ' ' LEU . 3.1 tm? -62.83 -44.34 96.41 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 119.988 -0.685 . . . . 0.0 110.25 -179.561 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.02 -43.32 99.07 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.587 179.834 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -60.19 -49.11 78.91 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 120.332 -0.547 . . . . 0.0 110.527 179.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.72 -52.35 57.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.035 -179.509 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.686 HG23 ' O ' ' A' ' 56' ' ' ILE . 7.6 tt -176.02 87.76 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.458 -0.073 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.941 -179.461 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -164.92 -57.17 0.02 OUTLIER Glycine 0 CA--C 1.52 0.389 0 N-CA-C 110.353 -1.099 . . . . 0.0 110.353 178.137 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 66.5 mtt 53.73 27.54 7.07 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.285 179.639 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.478 ' HG2' ' H ' ' A' ' 62' ' ' ALA . 70.6 tt0 -165.72 89.35 0.43 Allowed 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -74.1 -21.91 59.7 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.84 -179.328 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 78.1 p -67.15 -41.74 85.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.792 -179.873 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.478 ' H ' ' HG2' ' A' ' 59' ' ' GLU . . . -67.14 -32.12 73.03 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.473 179.78 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 83.6 t -69.99 -51.79 36.7 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.24 0 CA-C-N 116.488 -0.323 . . . . 0.0 110.778 179.829 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 99.3 p -60.33 -38.59 84.23 Favored 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 120.766 -0.374 . . . . 0.0 110.448 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 56.7 t-80 -66.39 -49.94 65.14 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-O 121.036 0.446 . . . . 0.0 110.703 -179.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 91.2 mm-40 -63.65 -38.01 89.51 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.242 179.658 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.412 HD21 ' CD1' ' A' ' 87' ' ' TYR . 7.5 tp -61.82 -45.27 94.54 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.002 -0.544 . . . . 0.0 109.776 -179.811 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 60.9 ttt85 -60.63 -45.16 95.09 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.499 -0.48 . . . . 0.0 110.483 -179.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 85.5 t -62.74 -54.65 31.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 C-N-CA 120.093 -0.643 . . . . 0.0 110.145 -179.457 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 78.4 mt -58.64 -35.15 72.07 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.08 0.467 . . . . 0.0 110.057 -179.196 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 70.0 ttt180 -60.43 -40.54 91.41 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.304 179.515 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 40.9 t-20 -62.36 -44.03 97.43 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 120.45 -0.5 . . . . 0.0 110.483 -179.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.482 HD23 ' N ' ' A' ' 73' ' ' LEU . 6.4 mt -67.88 -39.9 83.61 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.347 -179.212 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 104.66 29.0 5.48 Favored Glycine 0 CA--C 1.526 0.779 0 N-CA-C 110.808 -0.917 . . . . 0.0 110.808 -179.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 92.5 mt -90.28 -19.35 24.2 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.869 0.366 . . . . 0.0 110.838 179.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 21.8 m -135.82 158.25 39.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.097 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.426 HG23 ' CD2' ' A' ' 90' ' ' TYR . 39.3 t -141.59 155.88 20.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.508 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.416 ' N ' ' CG1' ' A' ' 77' ' ' VAL . . . -117.68 142.19 17.01 Favored Glycine 0 CA--C 1.524 0.649 0 N-CA-C 110.185 -1.166 . . . . 0.0 110.185 178.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -114.86 108.34 16.61 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 120.745 0.307 . . . . 0.0 110.311 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 60.9 ttp180 -80.89 131.68 35.38 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.796 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -142.01 120.83 12.71 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.938 0.399 . . . . 0.0 110.506 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 52.72 -117.52 6.66 Favored Glycine 0 CA--C 1.525 0.667 0 N-CA-C 110.533 -1.027 . . . . 0.0 110.533 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 52.9 ttp180 -110.34 34.09 4.12 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.257 0.551 . . . . 0.0 109.904 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 25.8 m -156.99 147.5 21.38 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 179.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -130.22 154.92 41.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.098 179.622 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.8 m -128.94 150.19 34.35 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.589 178.636 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.412 ' CD1' HD21 ' A' ' 67' ' ' LEU . 63.1 m-85 -106.81 133.64 51.16 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.061 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 74.5 m -151.23 171.71 16.98 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 64.0 mt -63.99 150.56 44.97 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.584 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.426 ' CD2' HG23 ' A' ' 77' ' ' VAL . 5.5 t80 -52.73 -48.65 66.52 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.398 -179.5 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 90.3 m-20 -139.71 166.92 23.32 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.078 0.466 . . . . 0.0 110.572 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . 0.481 ' O ' ' HB3' ' A' ' 95' ' ' ALA . 47.9 p -76.11 -24.22 54.96 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.835 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . 0.573 ' CB ' ' CE1' ' B' ' 223' ' ' HIS . 68.2 m80 -41.15 -60.12 1.32 Allowed 'General case' 0 C--O 1.237 0.416 0 CA-C-O 121.186 0.517 . . . . 0.0 110.72 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 10.8 m -55.81 -40.1 59.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.925 -0.58 . . . . 0.0 109.957 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.481 ' HB3' ' O ' ' A' ' 92' ' ' THR . . . -56.77 -41.15 77.1 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.987 0.422 . . . . 0.0 110.508 179.855 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.458 ' O ' ' OE1' ' A' ' 100' ' ' GLU . 6.1 tp-100 -64.76 -42.51 95.09 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.137 179.777 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 17.2 tp -59.6 -45.63 91.33 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.188 -0.605 . . . . 0.0 110.341 -178.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -65.51 -36.26 83.31 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.103 179.373 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 66.9 t0 -58.77 -43.17 90.33 Favored 'General case' 0 C--N 1.32 -0.706 0 C-N-CA 120.415 -0.514 . . . . 0.0 110.434 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.478 ' N ' ' OE1' ' A' ' 100' ' ' GLU . 2.7 mp0 -69.02 -50.41 49.04 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.484 179.786 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.432 ' HB2' ' CD1' ' B' ' 216' ' ' LEU . . . -59.35 -44.67 92.64 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.759 -0.376 . . . . 0.0 110.38 -179.685 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.571 HD13 HG21 ' B' ' 142' ' ' VAL . 4.8 mm -62.76 -45.04 99.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 C-N-CA 120.666 -0.414 . . . . 0.0 110.42 -179.264 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 73.2 t80 -64.09 -44.45 92.29 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.057 0.456 . . . . 0.0 110.389 179.838 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . 0.551 ' CE1' ' CB ' ' B' ' 212' ' ' HIS . 25.7 t60 -59.14 -39.17 81.52 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.74 179.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 12.3 t -77.04 -44.57 30.28 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.918 0.39 . . . . 0.0 111.25 179.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 79.5 tt0 -55.82 -31.1 62.39 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.472 -179.173 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -52.27 -70.76 0.08 Allowed 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.388 -0.525 . . . . 0.0 110.195 -179.214 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 50.0 mt -109.89 -142.45 0.38 Allowed 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 7.9 p80 -158.02 135.79 10.56 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.716 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.609 ' N ' HD22 ' A' ' 110' ' ' LEU . 3.9 mm? -63.71 -44.59 93.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.506 -179.528 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 67.55 -1.12 7.71 Favored Glycine 0 CA--C 1.526 0.74 0 N-CA-C 110.813 -0.915 . . . . 0.0 110.813 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 83.3 mt -77.65 -110.86 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.818 0.342 . . . . 0.0 110.548 -179.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 37.4 t 56.22 57.14 5.21 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.533 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -101.81 39.52 1.45 Allowed 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.538 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -71.29 127.93 34.2 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.141 179.769 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . 0.62 ' H ' ' CD ' ' A' ' 117' ' ' PRO . 0.1 OUTLIER -103.9 -43.05 0.18 Allowed Pre-proline 0 C--N 1.331 -0.222 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.473 179.757 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . 0.62 ' CD ' ' H ' ' A' ' 116' ' ' HIS . 31.9 Cg_exo -57.81 135.92 72.12 Favored 'Trans proline' 0 C--N 1.306 -1.709 0 C-N-CA 122.392 2.061 . . . . 0.0 111.868 -179.048 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 20.4 t -85.78 -47.52 9.65 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.432 179.602 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -65.14 -39.07 92.49 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.663 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.765 0 CA-C-O 117.986 -1.452 . . . . 0.0 110.936 -179.951 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.242 0 N-CA-C 109.544 -1.423 . . . . 0.0 109.544 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 88.2 m-70 -59.11 -43.0 91.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.853 0.359 . . . . 0.0 110.598 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 123' ' ' GLY . . . . . . . . . . . . . . . -164.9 117.17 0.74 Allowed Glycine 0 CA--C 1.523 0.57 0 N-CA-C 110.621 -0.992 . . . . 0.0 110.621 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 31.8 m -136.08 161.37 37.86 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 CA-C-O 120.907 0.384 . . . . 0.0 110.33 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 125' ' ' GLU . . . . . 0.491 ' CD ' ' N ' ' B' ' 125' ' ' GLU . 1.0 OUTLIER -130.84 133.38 45.88 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.151 -179.931 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -93.23 45.43 2.43 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 110.634 -0.986 . . . . 0.0 110.634 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 127' ' ' ARG . . . . . . . . . . . . . 78.6 ttt-85 -64.04 133.41 53.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.822 0.344 . . . . 0.0 110.388 -179.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 128' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -79.08 166.47 22.25 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.418 -179.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 129' ' ' ARG . . . . . . . . . . . . . 68.4 mtt180 61.84 62.1 2.45 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.593 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -75.49 44.07 1.17 Allowed 'Trans proline' 0 C--N 1.309 -1.503 0 C-N-CA 122.729 2.286 . . . . 0.0 111.993 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 73.8 m -64.32 146.54 54.24 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.375 179.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 132' ' ' ALA . . . . . . . . . . . . . . . -164.28 71.93 1.65 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.574 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 133' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -68.07 146.73 71.64 Favored 'Trans proline' 0 N--CA 1.491 1.355 0 C-N-CA 122.491 2.128 . . . . 0.0 111.581 -179.758 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . 0.435 ' C ' HD12 ' B' ' 134' ' ' LEU . 0.4 OUTLIER -99.62 23.62 9.28 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.301 -179.626 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -94.38 -62.55 1.31 Allowed 'General case' 0 C--O 1.236 0.359 0 CA-C-O 121.117 0.484 . . . . 0.0 110.81 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 78.3 p -62.38 -37.0 84.06 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.328 179.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -66.2 -47.28 74.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.267 179.548 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 138' ' ' ALA . . . . . 0.652 ' O ' HG23 ' B' ' 142' ' ' VAL . . . -56.33 -39.61 73.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.076 -179.77 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 139' ' ' ALA . . . . . 0.544 ' HB1' ' HB3' ' A' ' 36' ' ' LEU . . . -64.23 -54.09 38.86 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.512 -0.475 . . . . 0.0 110.392 179.614 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -58.75 -48.03 82.61 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.326 -179.643 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -61.93 -51.21 69.06 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.22 0.533 . . . . 0.0 111.006 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 142' ' ' VAL . . . . . 0.652 HG23 ' O ' ' B' ' 138' ' ' ALA . 96.1 t -61.02 -44.3 97.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.214 -179.699 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -57.5 -41.53 80.95 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 110.062 -0.347 . . . . 0.0 110.062 179.717 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 68.0 m -59.54 -44.08 93.32 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.199 179.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 71.4 m -62.8 -48.51 78.81 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 120.99 0.424 . . . . 0.0 110.962 179.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 92.7 mt -67.38 -21.59 65.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.528 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 147' ' ' GLN . . . . . 0.471 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 56.2 tt0 -75.3 -56.24 4.92 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.634 179.367 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 148' ' ' ALA . . . . . 0.457 ' HB1' HH22 ' B' ' 154' ' ' ARG . . . -58.94 -53.96 52.47 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.687 -179.552 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.477 ' O ' ' O ' ' B' ' 150' ' ' ALA . 91.2 mt -47.37 -34.92 7.52 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-O 120.846 0.355 . . . . 0.0 110.179 -179.177 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 150' ' ' ALA . . . . . 0.477 ' O ' ' O ' ' B' ' 149' ' ' LEU . . . -58.74 -140.68 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.54 179.177 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 151' ' ' THR . . . . . 0.428 ' O ' ' O ' ' B' ' 150' ' ' ALA . 29.3 m 57.16 112.04 0.02 OUTLIER Pre-proline 0 CA--C 1.54 0.572 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.951 -179.517 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -47.47 -58.39 1.76 Allowed 'Trans proline' 0 N--CA 1.5 1.866 0 C-N-CA 122.396 2.064 . . . . 0.0 113.376 -179.068 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 88.6 p -45.18 -47.67 12.44 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 121.33 0.585 . . . . 0.0 110.858 -178.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 154' ' ' ARG . . . . . 0.457 HH22 ' HB1' ' B' ' 148' ' ' ALA . 83.6 mtp180 -73.52 -25.21 60.32 Favored 'General case' 0 C--N 1.319 -0.729 0 C-N-CA 120.338 -0.545 . . . . 0.0 110.291 179.802 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 155' ' ' LEU . . . . . 0.565 ' HB3' ' HB1' ' A' ' 20' ' ' ALA . 0.2 OUTLIER -66.42 -55.98 13.18 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 119.855 -0.738 . . . . 0.0 111.283 -178.337 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.66 -45.28 90.86 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.585 179.5 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 97.0 mt -62.59 -45.23 99.32 Favored 'Isoleucine or valine' 0 C--O 1.241 0.653 0 CA-C-O 121.496 0.665 . . . . 0.0 110.406 -179.207 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 5.8 tt -63.21 -41.24 99.12 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.685 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 83.3 m -59.14 -42.84 91.6 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.843 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 17.5 mm100 -57.0 -45.24 83.16 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.966 179.516 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 161' ' ' LEU . . . . . 0.407 ' HA ' HD23 ' B' ' 161' ' ' LEU . 33.2 mt -66.26 -40.68 90.32 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.415 -0.514 . . . . 0.0 111.104 178.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 162' ' ' ARG . . . . . . . . . . . . . 73.7 ttp85 -60.24 -33.07 71.77 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.704 -179.71 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 17.5 t-20 -58.45 -40.52 82.83 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.383 -179.501 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . 168.58 168.92 31.35 Favored Glycine 0 CA--C 1.525 0.673 0 N-CA-C 110.984 -0.846 . . . . 0.0 110.984 179.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -65.83 144.42 77.22 Favored 'Trans proline' 0 C--N 1.308 -1.58 0 C-N-CA 122.836 2.357 . . . . 0.0 111.824 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 2.0 pp -176.23 147.39 0.83 Allowed Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.888 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -72.79 169.14 22.75 Favored 'Trans proline' 0 N--CA 1.496 1.674 0 C-N-CA 122.631 2.221 . . . . 0.0 112.129 179.058 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 168' ' ' VAL . . . . . 0.424 HG23 ' N ' ' B' ' 169' ' ' THR . 3.8 m -63.28 -38.27 81.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 121.446 0.641 . . . . 0.0 110.514 -179.69 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 169' ' ' THR . . . . . 0.424 ' N ' HG23 ' B' ' 168' ' ' VAL . 71.5 m -58.5 -44.81 89.56 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 114.597 -1.183 . . . . 0.0 110.35 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 53.6 t0 -69.03 -36.46 77.78 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.822 178.661 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 171' ' ' LEU . . . . . 0.667 ' C ' HD13 ' B' ' 171' ' ' LEU . 3.1 tm? -63.42 -44.17 95.39 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.001 -0.68 . . . . 0.0 110.308 -179.669 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 172' ' ' ALA . . . . . . . . . . . . . . . -61.0 -43.43 98.9 Favored 'General case' 0 CA--C 1.512 -0.494 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.541 179.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -59.93 -48.19 82.72 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 120.284 -0.566 . . . . 0.0 110.403 179.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -65.04 -52.77 53.99 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.026 -179.513 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 175' ' ' ILE . . . . . 0.657 ' O ' HG23 ' B' ' 175' ' ' ILE . 7.7 tt -176.17 87.42 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.456 -0.131 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.963 -179.425 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . -164.38 -57.41 0.02 OUTLIER Glycine 0 CA--C 1.522 0.491 0 N-CA-C 110.528 -1.029 . . . . 0.0 110.528 178.25 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 65.3 mtt 53.69 27.47 6.91 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.88 -0.328 . . . . 0.0 110.438 179.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 178' ' ' GLU . . . . . 0.507 ' HG2' ' H ' ' B' ' 181' ' ' ALA . 73.8 tt0 -164.62 87.73 0.47 Allowed 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 11.5 mt-30 -73.48 -23.09 60.02 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.822 -179.312 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 78.2 p -66.92 -41.2 87.47 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.86 -179.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 181' ' ' ALA . . . . . 0.507 ' H ' ' HG2' ' B' ' 178' ' ' GLU . . . -66.96 -33.29 75.24 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.27 179.739 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 77.9 t -69.69 -51.27 42.64 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.197 0 C-N-CA 120.721 -0.392 . . . . 0.0 110.781 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 92.1 p -59.28 -41.65 89.42 Favored 'General case' 0 C--N 1.332 -0.154 0 C-N-CA 120.675 -0.41 . . . . 0.0 110.566 -179.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 63.5 t-80 -66.26 -48.49 70.32 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-O 121.114 0.483 . . . . 0.0 110.757 -179.838 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 2.9 tp-100 -63.81 -37.43 87.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.107 -179.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 186' ' ' LEU . . . . . 0.426 HD21 ' CD1' ' B' ' 206' ' ' TYR . 9.8 tp -63.22 -44.26 95.78 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.917 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 61.6 ttt85 -59.76 -44.34 93.91 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.614 -0.434 . . . . 0.0 110.23 -179.663 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 90.1 t -63.38 -54.28 34.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 C-N-CA 120.021 -0.672 . . . . 0.0 110.215 -179.669 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 85.6 mt -58.96 -36.09 74.23 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.161 0.505 . . . . 0.0 109.989 -179.111 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 70.1 ttt180 -60.21 -41.91 94.05 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.205 179.412 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 39.2 t-20 -60.37 -47.23 86.94 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 120.431 -0.508 . . . . 0.0 110.388 -179.291 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 192' ' ' LEU . . . . . . . . . . . . . 9.7 mt -65.06 -39.58 93.47 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.918 0.39 . . . . 0.0 110.565 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 193' ' ' GLY . . . . . 0.4 ' O ' ' CD2' ' B' ' 209' ' ' TYR . . . 104.41 28.77 5.63 Favored Glycine 0 CA--C 1.525 0.715 0 N-CA-C 110.855 -0.898 . . . . 0.0 110.855 -179.768 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 92.8 mt -88.86 -19.65 25.62 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.911 0.386 . . . . 0.0 110.758 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 24.6 m -136.05 158.94 39.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.157 -0.474 . . . . 0.0 109.99 179.705 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 196' ' ' VAL . . . . . 0.441 HG23 ' CD2' ' B' ' 209' ' ' TYR . 41.3 t -141.71 156.29 20.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.442 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 197' ' ' GLY . . . . . 0.414 ' N ' ' CG1' ' B' ' 196' ' ' VAL . . . -117.6 142.23 17.07 Favored Glycine 0 CA--C 1.525 0.703 0 N-CA-C 110.202 -1.159 . . . . 0.0 110.202 179.151 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -114.82 108.3 16.57 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 120.664 0.269 . . . . 0.0 110.364 179.829 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 61.4 ttp180 -81.48 133.82 35.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.015 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 200' ' ' ALA . . . . . . . . . . . . . . . -145.15 125.13 13.53 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.536 179.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 201' ' ' GLY . . . . . . . . . . . . . . . 50.29 -117.83 5.39 Favored Glycine 0 CA--C 1.526 0.732 0 N-CA-C 110.602 -0.999 . . . . 0.0 110.602 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 202' ' ' ARG . . . . . . . . . . . . . 52.8 ttp180 -111.05 37.79 2.72 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.158 0.504 . . . . 0.0 109.946 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 69.7 m -161.01 150.03 16.59 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.809 -0.441 . . . . 0.0 109.809 179.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -132.23 154.18 39.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.1 179.658 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 26.8 m -127.67 150.05 33.16 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.373 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.548 178.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 206' ' ' TYR . . . . . 0.426 ' CD1' HD21 ' B' ' 186' ' ' LEU . 65.7 m-85 -106.96 133.74 51.15 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.118 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 58.2 m -151.38 171.79 16.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.274 -179.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . 68.9 mt -64.53 150.2 47.19 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.487 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 209' ' ' TYR . . . . . 0.441 ' CD2' HG23 ' B' ' 196' ' ' VAL . 5.9 t80 -52.59 -47.44 66.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.394 -179.59 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 89.0 m-20 -140.19 167.4 22.22 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 121.165 0.507 . . . . 0.0 110.603 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 211' ' ' THR . . . . . 0.498 ' O ' ' HB3' ' B' ' 214' ' ' ALA . 40.9 p -78.17 -23.88 47.48 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.668 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 212' ' ' HIS . . . . . 0.551 ' CB ' ' CE1' ' A' ' 104' ' ' HIS . 65.1 m80 -41.4 -59.46 1.56 Allowed 'General case' 0 C--O 1.236 0.373 0 CA-C-O 121.25 0.547 . . . . 0.0 110.552 -179.892 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 8.7 m -55.87 -41.07 65.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.815 -0.63 . . . . 0.0 109.884 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 214' ' ' ALA . . . . . 0.498 ' HB3' ' O ' ' B' ' 211' ' ' THR . . . -55.52 -40.91 72.4 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.471 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 215' ' ' GLN . . . . . 0.439 ' O ' ' OE1' ' B' ' 219' ' ' GLU . 7.1 tp-100 -65.23 -42.78 93.04 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.217 179.733 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 216' ' ' LEU . . . . . 0.432 ' CD1' ' HB2' ' A' ' 101' ' ' ALA . 12.6 tp -59.25 -46.0 89.67 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.166 -0.614 . . . . 0.0 110.387 -178.784 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -64.98 -37.09 86.49 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.983 179.282 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 43.6 t0 -58.12 -42.42 85.72 Favored 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 120.496 -0.482 . . . . 0.0 110.49 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 219' ' ' GLU . . . . . 0.494 ' OE1' ' N ' ' B' ' 219' ' ' GLU . 2.4 mp0 -69.34 -51.67 34.74 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.505 179.732 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -58.33 -44.67 88.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.346 -179.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 221' ' ' ILE . . . . . 0.593 HD13 HG21 ' A' ' 23' ' ' VAL . 4.8 mm -62.67 -44.9 99.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.601 -179.265 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 74.5 t80 -64.55 -43.71 93.11 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.069 0.462 . . . . 0.0 110.299 179.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 223' ' ' HIS . . . . . 0.573 ' CE1' ' CB ' ' A' ' 93' ' ' HIS . 32.4 t60 -59.65 -38.96 82.85 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.693 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 9.7 t -77.1 -44.94 28.68 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.991 0.424 . . . . 0.0 111.295 179.593 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -55.93 -31.16 62.67 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.438 -179.229 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -52.47 -70.91 0.08 Allowed 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.373 -0.531 . . . . 0.0 110.118 -179.326 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 227' ' ' LEU . . . . . . . . . . . . . 50.9 mt -109.23 -142.88 0.38 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.966 0.413 . . . . 0.0 109.902 -179.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 228' ' ' HIS . . . . . . . . . . . . . 8.0 p80 -157.97 134.42 9.59 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.582 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 229' ' ' LEU . . . . . 0.602 HD22 ' N ' ' B' ' 229' ' ' LEU . 4.0 mm? -63.13 -44.87 94.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.692 -179.793 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . 67.58 -0.64 9.02 Favored Glycine 0 CA--C 1.527 0.788 0 N-CA-C 110.917 -0.873 . . . . 0.0 110.917 179.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 231' ' ' LEU . . . . . . . . . . . . . 80.9 mt -77.48 -110.5 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.777 0.322 . . . . 0.0 110.556 -179.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 232' ' ' SER . . . . . . . . . . . . . 37.9 t 55.62 57.47 5.27 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.51 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 233' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -102.73 41.19 1.27 Allowed 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.408 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 234' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -72.65 128.73 36.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.255 179.748 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 235' ' ' HIS . . . . . 0.628 ' H ' ' CD ' ' B' ' 236' ' ' PRO . 0.1 OUTLIER -104.58 -43.03 0.17 Allowed Pre-proline 0 N--CA 1.463 0.222 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.487 179.93 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 236' ' ' PRO . . . . . 0.628 ' CD ' ' H ' ' B' ' 235' ' ' HIS . 31.5 Cg_exo -58.3 136.72 76.4 Favored 'Trans proline' 0 C--N 1.308 -1.604 0 C-N-CA 122.452 2.101 . . . . 0.0 111.876 -179.056 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 237' ' ' SER . . . . . . . . . . . . . 15.7 t -86.18 -48.19 8.79 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.389 179.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 238' ' ' ALA . . . . . . . . . . . . . . . -63.85 -39.57 94.52 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.721 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.752 0 CA-C-O 117.985 -1.453 . . . . 0.0 110.961 179.983 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.234 0 N-CA-C 109.481 -1.447 . . . . 0.0 109.481 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 86.8 m-70 -60.9 -44.49 97.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.864 0.364 . . . . 0.0 110.725 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -89.37 111.94 3.92 Favored Glycine 0 CA--C 1.524 0.608 0 N-CA-C 110.967 -0.853 . . . . 0.0 110.967 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.405 ' C ' ' H ' ' A' ' 7' ' ' GLY . 80.0 t -63.34 -45.15 98.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 120.959 0.409 . . . . 0.0 110.632 -179.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -75.51 41.95 0.2 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.643 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . 0.405 ' H ' ' C ' ' A' ' 5' ' ' VAL . . . -68.88 141.51 36.43 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 110.921 -0.871 . . . . 0.0 110.921 -179.947 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 82.9 mtp180 -78.28 146.83 34.58 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.822 0.344 . . . . 0.0 110.639 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 75.6 m-20 -72.01 141.33 49.33 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.429 179.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.443 ' N ' ' CD ' ' A' ' 11' ' ' PRO . 20.0 ptt180 -156.05 54.58 0.95 Allowed Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.694 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.443 ' CD ' ' N ' ' A' ' 10' ' ' ARG . 46.6 Cg_endo -69.17 164.21 34.82 Favored 'Trans proline' 0 C--N 1.306 -1.68 0 C-N-CA 122.872 2.381 . . . . 0.0 111.893 179.495 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 5.2 m -52.68 134.4 36.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.26 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.401 ' O ' ' NE2' ' A' ' 18' ' ' GLN . . . -170.93 71.81 0.54 Allowed Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.468 -179.751 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -76.58 86.75 1.53 Allowed 'Trans proline' 0 C--N 1.309 -1.552 0 C-N-CA 122.753 2.302 . . . . 0.0 111.979 -179.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 57.0 mt -87.81 -127.74 0.05 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.627 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -99.77 -59.2 1.76 Allowed 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.117 0.485 . . . . 0.0 111.169 179.541 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 58.5 m -53.86 -34.48 59.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.455 -179.22 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.401 ' NE2' ' O ' ' A' ' 13' ' ' ALA . 10.4 tt0 -68.03 -49.57 60.66 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.649 179.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.623 ' O ' HG23 ' A' ' 23' ' ' VAL . . . -54.74 -35.85 64.17 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 -179.934 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.32 -52.66 37.66 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.423 179.26 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.99 -49.2 77.63 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.797 0.332 . . . . 0.0 111.0 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 86.5 mt-30 -56.06 -50.95 69.54 Favored 'General case' 0 C--O 1.242 0.673 0 CA-C-O 121.279 0.561 . . . . 0.0 110.666 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.623 HG23 ' O ' ' A' ' 19' ' ' ALA . 90.6 t -60.49 -45.09 97.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.784 179.688 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.441 ' HB2' HD12 ' B' ' 155' ' ' LEU . . . -49.17 -46.17 45.04 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 121.014 -0.274 . . . . 0.0 110.391 179.216 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 36.0 t -59.56 -43.95 93.41 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.101 -0.499 . . . . 0.0 109.85 -179.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 20.2 m -65.68 -51.27 60.78 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.18 0.514 . . . . 0.0 110.812 179.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.544 ' CD1' HD13 ' B' ' 146' ' ' LEU . 4.1 mm? -62.26 -25.58 67.91 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.771 -179.896 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.493 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 54.7 tt0 -75.14 -53.38 8.95 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.849 179.499 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.47 -56.6 19.91 Favored 'General case' 0 CA--C 1.521 -0.171 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.838 -179.232 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.498 ' O ' ' O ' ' A' ' 31' ' ' ALA . 8.0 mp -45.11 -34.91 2.83 Favored 'General case' 0 CA--C 1.516 -0.364 0 C-N-CA 120.958 -0.297 . . . . 0.0 110.214 -179.237 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.498 ' O ' ' O ' ' A' ' 30' ' ' LEU . . . -57.31 -140.48 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.17 0.51 . . . . 0.0 110.357 179.291 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 37.7 m 59.66 110.1 0.02 OUTLIER Pre-proline 0 C--N 1.325 -0.487 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.308 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -51.15 -52.57 8.8 Favored 'Trans proline' 0 N--CA 1.496 1.641 0 C-N-CA 122.372 2.048 . . . . 0.0 113.155 -179.022 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 64.7 m -55.7 -45.48 77.85 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.902 -178.585 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 36.8 ttm180 -61.97 -44.44 96.75 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.733 -179.555 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.405 HD12 ' HB2' ' B' ' 143' ' ' ALA . 8.3 mt -62.08 -48.45 80.16 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.809 -0.356 . . . . 0.0 110.866 -179.666 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.468 ' O ' ' OG1' ' A' ' 40' ' ' THR . 49.8 ttp -53.95 -48.84 69.86 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-O 121.233 0.539 . . . . 0.0 110.204 179.612 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 97.9 mt -64.59 -42.72 95.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 121.342 0.591 . . . . 0.0 110.315 179.451 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 12.0 tp -62.24 -42.77 99.62 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.683 -179.273 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.468 ' OG1' ' O ' ' A' ' 37' ' ' MET . 21.3 p -59.52 -38.78 81.88 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.2 -0.455 . . . . 0.0 109.847 179.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.55 ' OE1' HD21 ' A' ' 52' ' ' LEU . 86.8 mt-30 -60.96 -46.47 90.6 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.536 -0.466 . . . . 0.0 110.005 178.798 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 92.8 mt -63.57 -38.78 92.45 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.755 179.268 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.42 ' O ' ' ND2' ' A' ' 44' ' ' ASN . 72.5 ttp85 -50.81 -42.82 58.6 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.418 -179.416 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.42 ' ND2' ' O ' ' A' ' 43' ' ' ARG . 12.8 m120 -135.36 48.81 2.22 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.375 179.582 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -175.23 78.77 0.08 OUTLIER Glycine 0 CA--C 1.529 0.959 0 N-CA-C 111.046 -0.822 . . . . 0.0 111.046 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -79.41 112.38 2.98 Favored 'Trans proline' 0 C--N 1.31 -1.461 0 C-N-CA 122.745 2.297 . . . . 0.0 111.504 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.575 HD12 ' O ' ' A' ' 47' ' ' LEU . 0.3 OUTLIER -160.75 156.01 21.16 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.622 -178.936 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -66.04 -178.66 1.12 Allowed 'Trans proline' 0 C--N 1.309 -1.527 0 C-N-CA 122.696 2.264 . . . . 0.0 111.89 179.034 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.571 HG23 ' N ' ' A' ' 50' ' ' THR . 3.5 m -68.06 -45.7 82.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 121.559 0.695 . . . . 0.0 111.383 -179.836 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.571 ' N ' HG23 ' A' ' 49' ' ' VAL . 58.3 p -55.85 -41.22 74.01 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.364 -0.834 . . . . 0.0 110.454 -179.516 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 66.9 m-20 -74.55 -40.24 61.82 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.507 179.457 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.74 HD23 ' O ' ' A' ' 52' ' ' LEU . 3.7 tt -60.98 -38.43 85.95 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.825 -179.658 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.585 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -69.63 -45.37 68.65 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.146 179.442 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 81.8 tt0 -52.76 -43.42 65.77 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.767 -0.373 . . . . 0.0 110.089 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -62.33 -42.95 99.8 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.538 179.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 96.6 mt -84.44 -67.12 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.454 179.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . 0.585 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 143.73 70.93 0.02 OUTLIER Glycine 0 CA--C 1.523 0.574 0 N-CA-C 111.141 -0.784 . . . . 0.0 111.141 179.672 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.426 ' C ' ' SD ' ' A' ' 58' ' ' MET . 2.7 tmm? 68.31 97.53 0.06 Allowed 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.76 -0.376 . . . . 0.0 110.762 179.647 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -173.85 24.9 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.078 0.466 . . . . 0.0 110.41 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -70.75 -23.58 62.45 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.044 0.45 . . . . 0.0 110.359 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 9.6 t -66.27 -44.37 83.8 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.584 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.1 -33.22 71.81 Favored 'General case' 0 C--O 1.24 0.605 0 CA-C-N 115.936 -0.575 . . . . 0.0 109.978 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 80.6 t -66.94 -49.99 68.79 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.083 179.713 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 50.5 m -53.04 -42.55 65.86 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 120.985 0.421 . . . . 0.0 110.163 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 83.4 t60 -58.3 -41.26 84.05 Favored 'General case' 0 C--O 1.242 0.697 0 CA-C-O 121.38 0.61 . . . . 0.0 109.63 178.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 55.1 tt0 -60.45 -38.86 85.51 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.859 -0.61 . . . . 0.0 109.993 179.249 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.644 ' HA ' HD23 ' A' ' 70' ' ' LEU . 24.0 mt -62.19 -42.35 99.2 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.391 179.861 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -55.26 -47.19 75.83 Favored 'General case' 0 C--O 1.24 0.575 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.874 179.481 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 90.7 t -68.31 -48.76 71.74 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.153 0 CA-C-O 121.172 0.51 . . . . 0.0 110.403 178.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.9 HD22 ' CG2' ' A' ' 76' ' ' VAL . 0.1 OUTLIER -49.06 -45.54 43.15 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 -179.277 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.632 ' N ' ' HG ' ' A' ' 70' ' ' LEU . 90.5 mtt-85 -62.35 -43.76 98.07 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.791 -178.508 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.43 ' C ' HD22 ' A' ' 73' ' ' LEU . 99.2 m-20 -65.34 -41.22 94.13 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.598 179.226 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.543 HD22 ' N ' ' A' ' 73' ' ' LEU . 4.0 mm? -95.61 -64.32 1.07 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.264 -179.135 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . 0.658 ' N ' ' O ' ' A' ' 70' ' ' LEU . . . 105.97 83.57 1.65 Allowed Glycine 0 CA--C 1.519 0.33 0 N-CA-C 110.54 -1.024 . . . . 0.0 110.54 -179.249 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 14.7 tp -125.64 -14.63 6.24 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.953 0.406 . . . . 0.0 110.549 -179.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.9 ' CG2' HD22 ' A' ' 70' ' ' LEU . 3.3 m -142.71 172.53 8.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.399 -179.763 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.449 HG23 ' HA ' ' A' ' 90' ' ' TYR . 24.6 t -137.62 150.93 25.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.577 178.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -128.58 146.92 17.26 Favored Glycine 0 CA--C 1.523 0.578 0 N-CA-C 110.446 -1.062 . . . . 0.0 110.446 179.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . 0.414 ' O ' HD12 ' A' ' 85' ' ' ILE . 96.9 m-20 -120.17 111.27 17.62 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 120.774 0.321 . . . . 0.0 110.435 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 38.5 ptt180 -77.77 151.75 33.9 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.574 179.656 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.455 ' O ' ' N ' ' A' ' 83' ' ' ARG . . . -155.1 94.1 1.6 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.579 179.674 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 57.18 -84.51 0.01 OUTLIER Glycine 0 CA--C 1.524 0.619 0 N-CA-C 110.72 -0.952 . . . . 0.0 110.72 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.455 ' N ' ' O ' ' A' ' 81' ' ' ALA . 35.2 ptt-85 -132.36 31.03 4.11 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 120.71 0.291 . . . . 0.0 110.644 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 41.2 t -146.84 126.13 13.06 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.892 0.377 . . . . 0.0 110.378 -179.787 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.414 HD12 ' O ' ' A' ' 79' ' ' ASP . 1.4 tp -120.86 129.54 75.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.834 179.576 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 64.8 t -107.09 128.57 61.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.029 178.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 94.3 m-85 -100.23 130.88 46.41 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.672 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 35.2 p -150.56 169.85 20.53 Favored 'General case' 0 C--O 1.223 -0.301 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 179.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 1.056 HD22 ' H ' ' A' ' 89' ' ' LEU . 0.6 OUTLIER -63.74 150.87 43.54 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.661 -179.626 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.466 ' N ' ' HA ' ' A' ' 76' ' ' VAL . 28.4 t80 -51.4 -48.9 62.47 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.244 -178.576 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.531 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 16.0 p-10 -153.05 -178.78 7.15 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.735 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 2.2 m -73.65 -3.26 27.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.422 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 8.5 t-160 -54.01 -74.85 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.062 0.458 . . . . 0.0 110.531 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 11.6 p -57.49 -33.81 45.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.324 -179.521 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.06 -47.67 84.9 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.633 179.694 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.44 ' O ' ' OE2' ' A' ' 100' ' ' GLU . 59.7 tt0 -63.87 -46.52 84.59 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.393 -179.749 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.448 ' CD1' ' HB2' ' B' ' 220' ' ' ALA . 13.8 tp -56.74 -45.7 81.83 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.221 -179.325 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 85.7 mt -63.32 -41.0 98.87 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.38 179.204 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -52.16 -45.04 64.91 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.41 -179.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.44 ' OE2' ' O ' ' A' ' 96' ' ' GLN . 0.9 OUTLIER -69.74 -50.46 43.27 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.666 -0.413 . . . . 0.0 110.903 179.782 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.408 ' HB2' ' CD1' ' B' ' 216' ' ' LEU . . . -57.92 -53.55 56.91 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.923 -178.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.439 ' N ' ' CD1' ' A' ' 102' ' ' ILE . 1.2 mp -61.74 -44.93 99.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.617 -179.688 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 78.3 t80 -61.23 -50.61 72.39 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 120.492 -0.483 . . . . 0.0 110.804 -179.024 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . 0.41 ' CB ' ' CD2' ' B' ' 212' ' ' HIS . 68.7 m-70 -63.29 -36.96 85.4 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.615 -179.654 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 6.2 t -72.07 -46.14 58.04 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.93 179.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 81.7 tt0 -60.4 -24.43 65.14 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.187 -179.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 12.2 t-80 -72.41 6.95 2.02 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.645 179.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.416 ' CG ' ' H ' ' A' ' 109' ' ' HIS . 8.0 tp -136.89 -130.39 0.14 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.719 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . 0.416 ' H ' ' CG ' ' A' ' 108' ' ' LEU . 0.1 OUTLIER -156.68 -4.28 0.11 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.667 -179.778 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.448 ' H ' HD12 ' A' ' 110' ' ' LEU . 11.1 mp 40.26 66.03 0.67 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.104 0.478 . . . . 0.0 110.534 -179.78 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -66.27 134.09 33.63 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 110.644 -0.982 . . . . 0.0 110.644 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.421 HD23 ' N ' ' A' ' 112' ' ' LEU . 0.1 OUTLIER -101.03 14.64 31.32 Favored 'General case' 0 N--CA 1.464 0.271 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 -179.608 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 86.4 p 52.33 -161.68 0.1 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.487 -179.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . 0.521 ' OD1' ' N ' ' A' ' 115' ' ' ARG . 62.0 t0 -132.15 143.34 49.91 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.402 -179.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.521 ' N ' ' OD1' ' A' ' 114' ' ' ASP . 33.3 mmt180 -61.79 -157.86 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.404 -179.818 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 24.9 m-70 59.78 71.73 0.86 Allowed Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.504 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_exo -55.39 -31.49 77.72 Favored 'Trans proline' 0 C--N 1.306 -1.668 0 C-N-CA 122.836 2.358 . . . . 0.0 111.943 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 35.5 t -61.59 143.55 55.85 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.549 -179.626 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . 52.14 81.77 0.08 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.566 -179.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.681 0 CA-C-O 118.012 -1.438 . . . . 0.0 110.958 -179.923 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.363 0 N-CA-C 109.494 -1.442 . . . . 0.0 109.494 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 88.1 m-70 -65.55 -41.93 92.45 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.686 0.279 . . . . 0.0 110.549 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 123' ' ' GLY . . . . . . . . . . . . . . . -89.84 111.95 3.95 Favored Glycine 0 CA--C 1.523 0.569 0 N-CA-C 111.0 -0.84 . . . . 0.0 111.0 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 89.3 t -63.51 -44.73 98.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.89 0.376 . . . . 0.0 110.587 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 125' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -77.34 43.95 0.4 Allowed 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.528 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -69.75 141.92 35.73 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 110.914 -0.874 . . . . 0.0 110.914 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 127' ' ' ARG . . . . . . . . . . . . . 83.1 mtp180 -78.41 143.98 36.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.83 0.348 . . . . 0.0 110.627 179.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 128' ' ' ASN . . . . . . . . . . . . . 70.7 m-80 -69.97 141.41 53.01 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.375 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 129' ' ' ARG . . . . . 0.439 ' N ' ' CD ' ' B' ' 130' ' ' PRO . 20.1 ptt180 -156.44 54.81 0.95 Allowed Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.739 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 130' ' ' PRO . . . . . 0.439 ' CD ' ' N ' ' B' ' 129' ' ' ARG . 48.8 Cg_endo -69.41 165.64 29.88 Favored 'Trans proline' 0 C--N 1.307 -1.618 0 C-N-CA 122.923 2.415 . . . . 0.0 111.92 179.533 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 5.9 m -52.95 135.46 36.59 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.32 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 132' ' ' ALA . . . . . 0.524 ' O ' ' NE2' ' B' ' 137' ' ' GLN . . . -172.32 71.57 0.44 Allowed Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.573 -179.724 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 133' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -77.16 86.67 1.59 Allowed 'Trans proline' 0 C--N 1.309 -1.543 0 C-N-CA 122.659 2.24 . . . . 0.0 111.933 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 55.5 mt -88.15 -126.65 0.05 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.453 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -100.21 -60.56 1.5 Allowed 'General case' 0 C--O 1.236 0.365 0 CA-C-O 121.194 0.521 . . . . 0.0 111.179 179.443 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 42.0 m -52.34 -35.76 51.74 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.435 -179.324 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 137' ' ' GLN . . . . . 0.524 ' NE2' ' O ' ' B' ' 132' ' ' ALA . 10.7 tt0 -66.86 -48.93 67.3 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.625 -179.849 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 138' ' ' ALA . . . . . 0.645 ' O ' HG23 ' B' ' 142' ' ' VAL . . . -55.35 -35.57 65.36 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 -179.825 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -67.19 -52.83 36.5 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.946 0.403 . . . . 0.0 110.433 179.33 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -58.13 -48.99 78.53 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.749 179.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 87.1 mt-30 -56.4 -51.09 69.63 Favored 'General case' 0 C--O 1.241 0.608 0 CA-C-O 121.303 0.573 . . . . 0.0 110.779 -179.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 142' ' ' VAL . . . . . 0.645 HG23 ' O ' ' B' ' 138' ' ' ALA . 93.5 t -60.47 -45.0 97.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.688 179.615 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 143' ' ' ALA . . . . . 0.405 ' HB2' HD12 ' A' ' 36' ' ' LEU . . . -49.84 -46.02 50.91 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.467 179.536 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 14.9 t -58.84 -45.89 88.99 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.207 -0.451 . . . . 0.0 109.933 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 22.9 m -64.61 -51.22 63.8 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 121.121 0.486 . . . . 0.0 110.915 179.244 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 146' ' ' LEU . . . . . 0.544 HD13 ' CD1' ' A' ' 27' ' ' LEU . 4.1 mm? -61.63 -26.7 68.16 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.718 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 147' ' ' GLN . . . . . 0.493 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 55.3 tt0 -75.01 -54.31 7.4 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.847 179.611 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -58.06 -55.9 28.92 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.754 -179.203 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.518 ' O ' ' O ' ' B' ' 150' ' ' ALA . 8.6 mp -45.55 -35.17 3.74 Favored 'General case' 0 CA--C 1.513 -0.479 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.264 -179.228 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 150' ' ' ALA . . . . . 0.518 ' O ' ' O ' ' B' ' 149' ' ' LEU . . . -56.79 -140.7 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.114 0.483 . . . . 0.0 110.434 179.32 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 151' ' ' THR . . . . . . . . . . . . . 84.5 m 59.54 109.38 0.03 OUTLIER Pre-proline 0 C--N 1.324 -0.536 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.336 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -50.46 -54.54 5.28 Favored 'Trans proline' 0 N--CA 1.497 1.689 0 C-N-CA 122.407 2.071 . . . . 0.0 113.066 -179.238 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 52.4 m -53.21 -45.7 68.74 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.953 -178.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 37.7 ttm180 -62.54 -44.28 96.74 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.749 -179.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 155' ' ' LEU . . . . . 0.441 HD12 ' HB2' ' A' ' 24' ' ' ALA . 8.6 mt -62.37 -46.72 87.38 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.831 -0.347 . . . . 0.0 110.918 -179.604 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 156' ' ' MET . . . . . 0.484 ' O ' ' OG1' ' B' ' 159' ' ' THR . 46.6 ttp -55.45 -49.07 73.43 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.298 0.571 . . . . 0.0 110.206 179.623 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 97.0 mt -64.62 -42.84 96.23 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 0 CA-C-O 121.276 0.56 . . . . 0.0 110.258 179.404 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 7.6 tp -62.1 -41.61 98.39 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.7 -179.257 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 159' ' ' THR . . . . . 0.484 ' OG1' ' O ' ' B' ' 156' ' ' MET . 16.9 p -60.67 -38.13 83.88 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.459 . . . . 0.0 109.956 179.85 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 87.1 mt-30 -61.75 -46.27 90.33 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.067 178.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 161' ' ' LEU . . . . . 0.414 HD23 ' HA ' ' B' ' 161' ' ' LEU . 90.4 mt -63.59 -38.72 92.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.713 179.267 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 162' ' ' ARG . . . . . 0.471 ' O ' ' ND2' ' B' ' 163' ' ' ASN . 73.7 ttp85 -50.23 -41.0 49.22 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.505 -179.425 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 163' ' ' ASN . . . . . 0.471 ' ND2' ' O ' ' B' ' 162' ' ' ARG . 16.0 m120 -138.4 49.83 1.9 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.376 179.736 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . -175.87 76.89 0.08 OUTLIER Glycine 0 CA--C 1.528 0.887 0 N-CA-C 111.119 -0.792 . . . . 0.0 111.119 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -77.43 114.34 3.71 Favored 'Trans proline' 0 N--CA 1.494 1.535 0 C-N-CA 122.8 2.333 . . . . 0.0 111.593 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 166' ' ' LEU . . . . . 0.492 ' O ' HD12 ' B' ' 166' ' ' LEU . 0.3 OUTLIER -160.36 157.37 24.32 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.656 -178.926 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -65.17 176.69 2.99 Favored 'Trans proline' 0 C--N 1.308 -1.595 0 C-N-CA 122.817 2.345 . . . . 0.0 111.753 179.006 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 168' ' ' VAL . . . . . 0.542 HG23 ' N ' ' B' ' 169' ' ' THR . 3.8 m -63.22 -43.47 98.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 121.522 0.677 . . . . 0.0 111.306 -179.718 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 169' ' ' THR . . . . . 0.542 ' N ' HG23 ' B' ' 168' ' ' VAL . 52.3 p -57.21 -66.65 0.42 Allowed 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.639 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 92.9 m-20 -50.02 -38.69 38.7 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 -179.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 171' ' ' LEU . . . . . 0.711 HD23 ' O ' ' B' ' 171' ' ' LEU . 5.0 tt -59.43 -41.91 90.64 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.59 -0.444 . . . . 0.0 109.999 179.531 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 172' ' ' ALA . . . . . 0.598 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -67.66 -43.19 80.84 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.55 -0.296 . . . . 0.0 110.306 179.386 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 85.3 tt0 -53.33 -42.36 66.65 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.054 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -62.83 -40.87 98.76 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.4 179.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 96.5 mt -87.87 -68.31 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.314 179.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 176' ' ' GLY . . . . . 0.598 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 144.75 72.75 0.02 OUTLIER Glycine 0 CA--C 1.524 0.62 0 N-CA-C 111.078 -0.809 . . . . 0.0 111.078 179.531 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 3.1 tmm? 67.26 97.95 0.05 Allowed 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.673 -0.411 . . . . 0.0 110.591 179.593 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -173.07 22.46 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.204 0.526 . . . . 0.0 110.431 179.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -69.15 -24.75 64.12 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.037 0.446 . . . . 0.0 110.384 -179.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 12.1 t -65.71 -43.65 88.47 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 121.182 0.515 . . . . 0.0 110.503 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -60.85 -32.41 71.82 Favored 'General case' 0 C--O 1.239 0.53 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.089 179.575 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 182' ' ' VAL . . . . . 0.407 ' O ' ' HG ' ' B' ' 186' ' ' LEU . 94.5 t -67.21 -50.56 62.05 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.375 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.102 179.544 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 70.0 m -53.02 -41.94 65.18 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 121.029 0.442 . . . . 0.0 110.129 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -58.59 -42.22 87.58 Favored 'General case' 0 C--O 1.242 0.676 0 CA-C-O 121.406 0.622 . . . . 0.0 109.788 178.634 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 58.4 tt0 -60.09 -38.67 83.63 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.087 179.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 186' ' ' LEU . . . . . 0.69 ' HA ' HD23 ' B' ' 189' ' ' LEU . 22.1 mt -62.24 -42.71 99.56 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-O 120.922 0.392 . . . . 0.0 110.52 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -54.95 -47.19 74.82 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.681 179.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 97.0 t -67.79 -48.85 74.11 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.106 0 C-N-CA 120.427 -0.509 . . . . 0.0 110.255 178.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 189' ' ' LEU . . . . . 0.901 HD22 ' CG2' ' B' ' 195' ' ' VAL . 0.1 OUTLIER -49.58 -45.4 47.76 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 -179.146 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 190' ' ' ARG . . . . . 0.63 ' N ' ' HG ' ' B' ' 189' ' ' LEU . 90.3 mtt-85 -61.81 -43.21 99.31 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.727 -0.67 . . . . 0.0 109.716 -178.485 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 191' ' ' ASN . . . . . 0.443 ' C ' HD22 ' B' ' 192' ' ' LEU . 99.3 m-20 -66.07 -41.07 91.26 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.937 179.153 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 192' ' ' LEU . . . . . 0.543 ' N ' HD22 ' B' ' 192' ' ' LEU . 4.0 mm? -95.8 -61.63 1.42 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.306 -178.862 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 193' ' ' GLY . . . . . 0.686 ' N ' ' O ' ' B' ' 189' ' ' LEU . . . 103.05 82.47 1.63 Allowed Glycine 0 CA--C 1.52 0.349 0 N-CA-C 110.462 -1.055 . . . . 0.0 110.462 -179.42 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 15.6 tp -124.68 -15.0 6.66 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-O 120.951 0.405 . . . . 0.0 110.743 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 195' ' ' VAL . . . . . 0.901 ' CG2' HD22 ' B' ' 189' ' ' LEU . 3.0 m -142.2 171.91 9.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.376 -179.724 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 196' ' ' VAL . . . . . 0.448 HG23 ' HA ' ' B' ' 209' ' ' TYR . 24.7 t -137.76 152.17 26.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.473 178.745 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 197' ' ' GLY . . . . . . . . . . . . . . . -130.68 148.36 18.7 Favored Glycine 0 CA--C 1.522 0.494 0 N-CA-C 110.54 -1.024 . . . . 0.0 110.54 179.23 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 198' ' ' ASP . . . . . 0.43 ' O ' HD12 ' B' ' 204' ' ' ILE . 89.1 m-20 -120.7 112.87 19.41 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 120.803 0.335 . . . . 0.0 110.621 -179.784 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 37.1 ptt180 -79.13 150.23 31.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.465 179.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 200' ' ' ALA . . . . . 0.454 ' O ' ' N ' ' B' ' 202' ' ' ARG . . . -153.46 94.29 1.79 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.649 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 201' ' ' GLY . . . . . . . . . . . . . . . 57.91 -83.34 0.01 OUTLIER Glycine 0 CA--C 1.523 0.565 0 N-CA-C 110.793 -0.923 . . . . 0.0 110.793 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 202' ' ' ARG . . . . . 0.454 ' N ' ' O ' ' B' ' 200' ' ' ALA . 36.3 ptt-85 -133.85 28.87 3.85 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 120.664 0.268 . . . . 0.0 110.722 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 38.8 t -143.89 127.1 16.63 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.293 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 204' ' ' ILE . . . . . 0.43 HD12 ' O ' ' B' ' 198' ' ' ASP . 1.5 tp -121.29 128.39 75.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.161 -0.472 . . . . 0.0 109.894 179.58 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 71.2 t -105.63 129.52 58.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.071 178.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -101.27 130.76 47.46 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.675 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 18.0 p -151.13 170.3 19.77 Favored 'General case' 0 C--O 1.223 -0.339 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 208' ' ' LEU . . . . . 1.044 HD22 ' H ' ' B' ' 208' ' ' LEU . 0.5 OUTLIER -63.41 152.07 39.23 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.653 -179.583 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 209' ' ' TYR . . . . . 0.478 ' N ' ' HA ' ' B' ' 195' ' ' VAL . 29.0 t80 -53.96 -48.38 70.37 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.234 -178.578 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 210' ' ' ASP . . . . . 0.531 ' N ' ' OD1' ' B' ' 210' ' ' ASP . 16.3 p-10 -151.56 179.8 8.06 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.74 179.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 2.5 m -74.19 -1.81 22.01 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.473 -179.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 212' ' ' HIS . . . . . 0.41 ' CD2' ' CB ' ' A' ' 104' ' ' HIS . 9.0 t-160 -56.04 -73.63 0.06 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.992 0.425 . . . . 0.0 110.46 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 9.6 p -57.54 -33.02 43.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.319 -179.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 214' ' ' ALA . . . . . . . . . . . . . . . -61.34 -47.96 83.52 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.637 179.699 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 215' ' ' GLN . . . . . 0.443 ' O ' ' OE1' ' B' ' 219' ' ' GLU . 59.4 tt0 -63.69 -46.28 86.23 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.338 -179.698 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 216' ' ' LEU . . . . . 0.408 ' CD1' ' HB2' ' A' ' 101' ' ' ALA . 14.5 tp -56.58 -46.11 80.98 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.217 -179.262 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 86.0 mt -63.53 -39.63 94.92 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.281 179.284 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -52.79 -45.44 67.17 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.4 -179.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 219' ' ' GLU . . . . . 0.443 ' OE1' ' O ' ' B' ' 215' ' ' GLN . 1.1 mp0 -70.44 -48.53 55.49 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.98 179.761 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 220' ' ' ALA . . . . . 0.448 ' HB2' ' CD1' ' A' ' 97' ' ' LEU . . . -59.21 -53.4 58.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.046 -179.003 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 221' ' ' ILE . . . . . 0.437 ' N ' ' CD1' ' B' ' 221' ' ' ILE . 1.2 mp -62.27 -44.82 99.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.663 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 75.9 t80 -61.07 -49.9 75.46 Favored 'General case' 0 C--N 1.32 -0.691 0 C-N-CA 120.475 -0.49 . . . . 0.0 110.747 -179.088 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 223' ' ' HIS . . . . . . . . . . . . . 56.4 m-70 -64.06 -37.18 86.49 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.727 -179.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 9.1 t -71.69 -45.99 60.16 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.915 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -60.71 -23.63 65.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.369 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 9.8 t-80 -72.47 7.16 1.95 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.615 179.511 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 227' ' ' LEU . . . . . 0.428 HD23 ' H ' ' B' ' 229' ' ' LEU . 4.8 tp -138.19 -131.97 0.13 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.697 -179.837 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 228' ' ' HIS . . . . . 0.415 ' H ' ' CG ' ' B' ' 227' ' ' LEU . 0.1 OUTLIER -154.73 -2.7 0.16 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.735 -179.871 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 229' ' ' LEU . . . . . 0.442 ' H ' HD12 ' B' ' 229' ' ' LEU . 11.0 mp 39.57 65.73 0.67 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.271 0.558 . . . . 0.0 110.49 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -65.16 134.01 36.64 Favored Glycine 0 CA--C 1.525 0.663 0 N-CA-C 110.663 -0.975 . . . . 0.0 110.663 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 231' ' ' LEU . . . . . 0.406 HD23 ' N ' ' B' ' 231' ' ' LEU . 0.1 OUTLIER -101.7 14.88 30.65 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 110.131 -0.322 . . . . 0.0 110.131 -179.771 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 232' ' ' SER . . . . . . . . . . . . . 82.1 p 52.1 -160.98 0.1 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.586 -179.695 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 233' ' ' ASP . . . . . 0.524 ' OD1' ' N ' ' B' ' 234' ' ' ARG . 66.2 t0 -133.64 140.57 47.17 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.458 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 234' ' ' ARG . . . . . 0.524 ' N ' ' OD1' ' B' ' 233' ' ' ASP . 34.2 mmt180 -58.65 -158.9 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.381 -179.807 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 235' ' ' HIS . . . . . . . . . . . . . 25.9 m-70 60.91 71.86 0.77 Allowed Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.62 -179.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 236' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_exo -54.89 -32.93 80.09 Favored 'Trans proline' 0 C--N 1.307 -1.643 0 C-N-CA 122.824 2.349 . . . . 0.0 111.991 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 237' ' ' SER . . . . . . . . . . . . . 47.3 t -60.11 145.76 45.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.43 -179.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 238' ' ' ALA . . . . . . . . . . . . . . . 48.39 81.15 0.05 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.469 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.75 0 CA-C-O 118.022 -1.432 . . . . 0.0 110.907 179.865 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.263 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 80.5 m80 -85.34 125.42 32.93 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.848 0.356 . . . . 0.0 110.442 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -74.55 150.84 42.28 Favored Glycine 0 CA--C 1.523 0.549 0 N-CA-C 110.815 -0.914 . . . . 0.0 110.815 179.857 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 64.8 t -125.02 132.12 71.7 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.383 0 CA-C-O 120.849 0.357 . . . . 0.0 110.172 179.816 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 82.3 tt0 -90.57 99.03 12.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.038 179.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . 0.45 ' O ' ' O ' ' A' ' 8' ' ' ARG . . . -91.34 2.28 77.93 Favored Glycine 0 CA--C 1.523 0.562 0 N-CA-C 110.941 -0.863 . . . . 0.0 110.941 179.87 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.45 ' O ' ' O ' ' A' ' 7' ' ' GLY . 96.2 mtt-85 50.85 104.64 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.779 0.323 . . . . 0.0 110.439 -179.911 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.439 ' ND2' ' O ' ' A' ' 8' ' ' ARG . 27.7 m120 -147.79 170.51 17.44 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.927 0.394 . . . . 0.0 110.449 -179.822 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 9.1 tpp85 -157.96 63.45 2.72 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.69 -179.804 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -74.15 160.55 42.38 Favored 'Trans proline' 0 C--N 1.308 -1.6 0 C-N-CA 122.951 2.434 . . . . 0.0 112.263 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 82.5 p -72.55 164.15 26.9 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.253 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.456 ' C ' HE21 ' A' ' 18' ' ' GLN . . . -155.62 62.6 3.28 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.541 -179.84 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -70.19 154.67 65.84 Favored 'Trans proline' 0 C--N 1.31 -1.498 0 C-N-CA 122.891 2.394 . . . . 0.0 111.654 179.795 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.494 HD23 ' H ' ' A' ' 15' ' ' LEU . 0.1 OUTLIER -82.12 8.9 9.63 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.177 -179.696 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -96.35 -62.3 1.3 Allowed 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.12 0.486 . . . . 0.0 110.768 179.409 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 46.0 m -59.18 -33.35 70.84 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.228 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.456 HE21 ' C ' ' A' ' 13' ' ' ALA . 75.1 mt-30 -67.56 -49.15 64.57 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.496 179.69 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -57.95 -36.07 72.02 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.927 -0.309 . . . . 0.0 110.289 -179.826 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.71 -53.52 26.9 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 120.884 0.373 . . . . 0.0 110.492 179.637 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.08 -42.07 99.55 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.912 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 16.5 mm100 -61.32 -52.9 62.75 Favored 'General case' 0 C--O 1.239 0.509 0 CA-C-O 121.304 0.573 . . . . 0.0 110.644 -179.603 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 74.4 t -62.19 -47.09 94.75 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.854 179.589 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -53.13 -42.81 66.4 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 120.809 -0.356 . . . . 0.0 110.252 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 50.0 m -59.55 -43.39 93.56 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.332 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 17.6 m -64.42 -51.98 60.47 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 120.449 -0.5 . . . . 0.0 110.725 179.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.445 ' N ' ' CD1' ' A' ' 27' ' ' LEU . 7.9 mp -66.16 -20.02 66.01 Favored 'General case' 0 CA--C 1.513 -0.457 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.615 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.445 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 54.1 tt0 -74.01 -63.44 1.22 Allowed 'General case' 0 C--N 1.32 -0.687 0 O-C-N 123.418 0.449 . . . . 0.0 110.842 179.697 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -57.47 -51.96 67.32 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.939 -179.191 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.437 ' O ' ' C ' ' A' ' 31' ' ' ALA . 4.1 mm? -54.52 -39.15 67.35 Favored 'General case' 0 CA--C 1.508 -0.645 0 C-N-CA 120.876 -0.329 . . . . 0.0 110.279 -178.851 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.555 ' O ' ' C ' ' A' ' 32' ' ' THR . . . -37.67 -69.31 0.12 Allowed 'General case' 0 CA--C 1.511 -0.549 0 O-C-N 123.531 0.519 . . . . 0.0 110.062 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.555 ' C ' ' O ' ' A' ' 31' ' ' ALA . 15.9 m -5.57 111.57 0.03 OUTLIER Pre-proline 0 CA--C 1.54 0.595 0 O-C-N 124.851 1.344 . . . . 0.0 111.124 -179.334 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_exo -45.75 -42.9 19.39 Favored 'Trans proline' 0 C--N 1.309 -1.511 0 C-N-CA 122.246 1.964 . . . . 0.0 112.652 -178.008 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 67.5 m -57.66 -46.69 83.9 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.609 -179.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -67.06 -36.85 82.93 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.053 0.454 . . . . 0.0 110.179 179.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.465 HD13 ' O ' ' A' ' 36' ' ' LEU . 0.2 OUTLIER -59.2 -52.85 63.91 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 120.097 -0.641 . . . . 0.0 110.725 -178.047 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 64.2 ttp -62.74 -44.48 96.1 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.938 179.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 89.3 mt -60.26 -44.56 95.89 Favored 'Isoleucine or valine' 0 C--O 1.242 0.678 0 CA-C-O 121.584 0.707 . . . . 0.0 110.685 -178.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -63.84 -39.0 93.18 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.632 179.639 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 14.9 m -59.02 -39.32 81.57 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.797 179.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -62.31 -44.77 95.73 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.235 179.627 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.449 ' O ' ' N ' ' A' ' 45' ' ' GLY . 23.6 mt -62.51 -43.12 99.58 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 120.504 -0.478 . . . . 0.0 111.293 179.686 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.504 HH21 ' CG ' ' A' ' 99' ' ' ASP . 79.3 ttt-85 -40.14 -31.12 0.11 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.685 -179.703 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 78.3 m-20 -60.07 -42.3 94.25 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.267 -179.497 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.449 ' N ' ' O ' ' A' ' 42' ' ' LEU . . . 126.29 -116.08 2.46 Favored Glycine 0 CA--C 1.535 1.339 0 N-CA-C 111.384 -0.686 . . . . 0.0 111.384 179.204 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -73.95 128.83 12.7 Favored 'Trans proline' 0 N--CA 1.495 1.609 0 C-N-CA 122.271 1.981 . . . . 0.0 112.434 -179.153 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -176.33 86.46 0.27 Allowed Pre-proline 0 C--N 1.327 -0.407 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.445 179.443 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -49.35 171.12 0.08 OUTLIER 'Trans proline' 0 C--N 1.306 -1.688 0 C-N-CA 122.742 2.294 . . . . 0.0 112.281 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 70.4 t -55.4 -44.28 75.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.25 -179.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 19.0 m -61.75 -44.32 97.12 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.284 179.207 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 66.2 t0 -63.94 -40.35 96.25 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-O 121.383 0.611 . . . . 0.0 110.296 179.692 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.616 HD23 ' O ' ' A' ' 52' ' ' LEU . 5.1 tt -61.31 -44.19 97.62 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.778 -0.646 . . . . 0.0 109.831 -179.741 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.579 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -59.21 -43.73 92.27 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 179.543 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 84.7 tt0 -54.56 -47.05 73.72 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.068 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -57.89 -49.98 74.87 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.546 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.455 HD12 ' CD2' ' A' ' 52' ' ' LEU . 96.8 mt -85.36 -73.76 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.522 -0.126 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.238 179.688 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . 0.579 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 131.74 77.37 0.14 Allowed Glycine 0 N--CA 1.461 0.331 0 N-CA-C 111.472 -0.651 . . . . 0.0 111.472 179.218 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.473 ' CB ' ' O ' ' A' ' 57' ' ' GLY . 23.2 ttm 80.93 99.26 0.06 Allowed 'General case' 0 C--O 1.234 0.239 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.955 178.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 179.32 22.18 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.165 179.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 55.3 mt-30 -56.92 -27.82 61.34 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 120.825 0.345 . . . . 0.0 111.135 -179.145 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 45.7 m -70.04 -45.83 66.33 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 120.931 0.396 . . . . 0.0 111.212 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.26 -29.3 70.65 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.116 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 70.0 t -72.66 -52.21 24.25 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.246 0 C-N-CA 120.546 -0.461 . . . . 0.0 110.596 179.751 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 11.1 t -55.2 -43.37 74.34 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.303 -0.559 . . . . 0.0 110.558 -179.383 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 60.0 t-80 -69.62 -49.45 53.81 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.364 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 70.1 tp60 -58.98 -45.35 90.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.58 -179.231 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.401 ' O ' ' CG ' ' A' ' 71' ' ' ARG . 3.1 mm? -63.63 -40.11 96.06 Favored 'General case' 0 CA--C 1.502 -0.878 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.479 -179.885 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 72.1 ttt180 -58.24 -43.63 87.89 Favored 'General case' 0 C--N 1.303 -1.414 0 C-N-CA 120.016 -0.673 . . . . 0.0 110.099 179.364 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 91.9 t -67.84 -53.83 27.52 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.385 179.692 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.599 ' O ' ' N ' ' A' ' 74' ' ' GLY . 94.2 mt -57.93 -38.38 75.83 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-N 116.151 -0.477 . . . . 0.0 109.807 -179.507 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.401 ' CG ' ' O ' ' A' ' 67' ' ' LEU . 11.0 mmm180 -59.93 -43.42 94.95 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.139 179.658 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.42 ' CB ' HD23 ' A' ' 73' ' ' LEU . 88.1 m-20 -64.88 -43.44 92.92 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 120.466 -0.494 . . . . 0.0 110.314 179.78 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.42 HD23 ' CB ' ' A' ' 72' ' ' ASN . 0.4 OUTLIER -153.93 73.02 0.92 Allowed 'General case' 0 C--N 1.334 -0.067 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.755 179.28 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . 0.599 ' N ' ' O ' ' A' ' 70' ' ' LEU . . . -147.2 1.05 0.73 Allowed Glycine 0 N--CA 1.464 0.564 0 N-CA-C 110.882 -0.887 . . . . 0.0 110.882 -179.738 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.577 HD22 ' N ' ' A' ' 75' ' ' LEU . 3.8 mm? 55.43 61.25 2.95 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.849 0.357 . . . . 0.0 110.994 179.523 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 34.0 m -132.52 156.25 42.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.193 179.217 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.727 HG12 ' N ' ' A' ' 78' ' ' GLY . 60.3 t -131.83 174.04 13.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.239 -179.651 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.727 ' N ' HG12 ' A' ' 77' ' ' VAL . . . -165.29 159.21 32.32 Favored Glycine 0 CA--C 1.526 0.739 0 N-CA-C 110.519 -1.032 . . . . 0.0 110.519 179.07 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 -115.67 116.52 28.24 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 120.753 0.311 . . . . 0.0 110.697 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 62.3 ttp180 -86.69 137.71 32.24 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.272 179.672 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.446 ' O ' ' N ' ' A' ' 83' ' ' ARG . . . -148.8 172.85 13.97 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.483 -179.766 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -41.22 94.96 0.01 OUTLIER Glycine 0 CA--C 1.527 0.823 0 N-CA-C 111.023 -0.831 . . . . 0.0 111.023 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.446 ' N ' ' O ' ' A' ' 81' ' ' ALA . 17.5 mmm180 50.13 45.02 25.99 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.886 0.374 . . . . 0.0 110.629 179.888 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 28.5 t -160.23 108.68 1.69 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.548 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 2.2 tp -116.22 129.77 72.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 120.942 0.401 . . . . 0.0 110.064 179.552 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 72.8 t -106.67 131.1 57.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 179.037 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 99.7 m-85 -106.35 130.44 54.18 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.621 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 66.9 m -150.5 171.04 17.7 Favored 'General case' 0 C--N 1.341 0.2 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 49.4 mt -79.24 146.82 32.82 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.56 -179.707 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 6.0 t80 -56.08 -48.06 76.8 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.654 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 75.6 m-20 -125.47 176.39 6.85 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 116.433 -0.348 . . . . 0.0 110.291 -179.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 22.3 p -99.8 -1.84 36.57 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.323 -179.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . 0.572 ' CE1' ' CD2' ' B' ' 223' ' ' HIS . 60.8 m80 -53.61 -55.33 26.77 Favored 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 120.855 -0.338 . . . . 0.0 110.376 -179.817 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.491 ' HA ' HD21 ' A' ' 97' ' ' LEU . 61.4 t -44.5 -39.01 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.047 0.451 . . . . 0.0 110.322 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -71.68 -36.5 70.64 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.939 179.555 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 96.2 mm-40 -64.3 -53.28 51.44 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.188 0.518 . . . . 0.0 111.285 -178.719 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.491 HD21 ' HA ' ' A' ' 94' ' ' VAL . 3.2 pp -67.94 -39.93 83.39 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.557 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.447 ' N ' HD12 ' A' ' 97' ' ' LEU . 6.4 tt -65.36 -41.37 93.88 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.226 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . 0.504 ' CG ' HH21 ' A' ' 43' ' ' ARG . 78.4 m-20 -61.86 -38.35 87.93 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.845 -179.646 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.424 ' OE2' ' OE2' ' B' ' 219' ' ' GLU . 97.9 mt-10 -71.67 -44.68 63.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.847 179.308 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -63.06 -49.83 72.99 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.57 -179.637 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.425 HD13 ' HG ' ' A' ' 98' ' ' LEU . 1.2 mp -63.77 -43.83 98.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.875 178.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 89.2 t80 -60.02 -47.82 84.26 Favored 'General case' 0 C--N 1.313 -0.991 0 C-N-CA 120.626 -0.43 . . . . 0.0 110.831 -179.26 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . 0.519 ' CD2' ' CE1' ' B' ' 212' ' ' HIS . 11.7 t-160 -66.65 -35.98 81.47 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.124 179.765 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 4.4 t -73.3 -49.61 26.64 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.002 0.43 . . . . 0.0 111.487 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -67.28 -21.18 65.71 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.626 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 19.8 t60 -51.13 -69.79 0.1 Allowed 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 120.694 -0.403 . . . . 0.0 110.426 -179.277 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 58.4 mt -78.19 -57.95 3.52 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.965 0.412 . . . . 0.0 110.632 -179.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 64.7 t-80 44.37 86.86 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.615 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 93.8 mt -62.9 -42.94 99.96 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.598 -179.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 75.46 5.21 77.12 Favored Glycine 0 N--CA 1.453 -0.17 0 N-CA-C 110.805 -0.918 . . . . 0.0 110.805 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.579 HD13 ' N ' ' A' ' 113' ' ' SER . 0.2 OUTLIER -115.47 115.17 26.06 Favored 'General case' 0 CA--C 1.521 -0.158 0 CA-C-O 120.833 0.349 . . . . 0.0 110.228 -179.831 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.579 ' N ' HD13 ' A' ' 112' ' ' LEU . 41.3 t -154.33 166.06 34.39 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.506 179.489 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . 0.409 ' OD1' ' O ' ' A' ' 114' ' ' ASP . 47.2 p-10 -90.16 91.0 8.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.651 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 80.2 mmt-85 -79.98 148.14 31.29 Favored 'General case' 0 CA--C 1.515 -0.376 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.48 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 2.9 p-80 -155.01 151.58 23.38 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.406 179.77 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo -67.02 -70.89 0.02 OUTLIER 'Trans proline' 0 N--CA 1.494 1.501 0 C-N-CA 122.564 2.176 . . . . 0.0 112.252 179.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 30.6 p -80.65 159.65 25.28 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.654 -179.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -69.93 143.76 52.61 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.555 179.849 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.675 0 CA-C-O 117.885 -1.508 . . . . 0.0 110.928 179.992 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.299 0 N-CA-C 109.591 -1.404 . . . . 0.0 109.591 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 80.1 m80 -98.18 126.33 43.59 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.881 0.372 . . . . 0.0 110.283 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 123' ' ' GLY . . . . . . . . . . . . . . . -73.13 149.49 42.65 Favored Glycine 0 CA--C 1.523 0.552 0 N-CA-C 110.693 -0.963 . . . . 0.0 110.693 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 56.7 t -124.33 130.52 73.61 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 CA-C-O 120.88 0.372 . . . . 0.0 110.11 179.764 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 125' ' ' GLU . . . . . . . . . . . . . 79.4 tt0 -88.86 97.91 11.43 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.153 179.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . 0.439 ' O ' ' O ' ' B' ' 127' ' ' ARG . . . -90.62 0.72 77.63 Favored Glycine 0 CA--C 1.523 0.575 0 N-CA-C 110.835 -0.906 . . . . 0.0 110.835 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 127' ' ' ARG . . . . . 0.483 ' O ' ' ND2' ' B' ' 128' ' ' ASN . 96.2 mtt-85 51.97 106.07 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.85 0.357 . . . . 0.0 110.485 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 128' ' ' ASN . . . . . 0.483 ' ND2' ' O ' ' B' ' 127' ' ' ARG . 26.7 m120 -148.69 171.07 16.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.467 -179.787 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 129' ' ' ARG . . . . . . . . . . . . . 9.0 tpp85 -158.73 62.03 2.1 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.664 -179.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -73.32 161.74 42.05 Favored 'Trans proline' 0 C--N 1.307 -1.643 0 C-N-CA 122.891 2.394 . . . . 0.0 112.293 -179.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 10.4 p -73.24 163.53 27.97 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.199 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 132' ' ' ALA . . . . . 0.463 ' C ' HE21 ' B' ' 137' ' ' GLN . . . -154.9 64.36 4.27 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.524 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 133' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -71.94 154.09 58.12 Favored 'Trans proline' 0 C--N 1.312 -1.377 0 C-N-CA 122.879 2.386 . . . . 0.0 111.778 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . 0.525 ' H ' HD23 ' B' ' 134' ' ' LEU . 0.1 OUTLIER -81.68 8.73 9.19 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.948 -179.78 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 92.8 m-20 -96.19 -62.25 1.31 Allowed 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.222 0.534 . . . . 0.0 110.722 179.54 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 65.0 m -59.85 -33.04 71.26 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.323 179.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 137' ' ' GLN . . . . . 0.463 HE21 ' C ' ' B' ' 132' ' ' ALA . 75.0 mt-30 -67.88 -49.52 61.55 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.467 179.741 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 138' ' ' ALA . . . . . 0.456 ' O ' HG23 ' B' ' 142' ' ' VAL . . . -57.49 -35.63 70.45 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.89 -0.324 . . . . 0.0 110.287 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -67.54 -53.35 29.14 Favored 'General case' 0 CA--C 1.528 0.133 0 C-N-CA 120.759 -0.377 . . . . 0.0 110.534 179.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -63.06 -41.31 99.42 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.872 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 19.6 mm100 -62.08 -52.86 62.21 Favored 'General case' 0 C--O 1.239 0.542 0 CA-C-O 121.068 0.461 . . . . 0.0 110.603 -179.571 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 142' ' ' VAL . . . . . 0.456 HG23 ' O ' ' B' ' 138' ' ' ALA . 84.2 t -62.28 -46.96 95.22 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 179.598 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -53.17 -43.11 66.83 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.193 179.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 69.3 m -59.17 -44.45 92.16 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.426 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 21.6 m -64.52 -51.5 62.6 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.715 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 146' ' ' LEU . . . . . 0.418 ' N ' ' CD1' ' B' ' 146' ' ' LEU . 8.3 mp -66.09 -20.16 66.07 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.681 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 147' ' ' GLN . . . . . 0.471 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 58.3 tt0 -74.62 -62.93 1.36 Allowed 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.889 179.818 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -57.91 -52.55 65.01 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.138 -179.12 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.427 ' O ' ' C ' ' B' ' 150' ' ' ALA . 4.2 mm? -53.78 -37.57 63.58 Favored 'General case' 0 CA--C 1.508 -0.665 0 C-N-CA 120.794 -0.362 . . . . 0.0 110.194 -178.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 150' ' ' ALA . . . . . 0.552 ' O ' ' C ' ' B' ' 151' ' ' THR . . . -39.31 -70.16 0.11 Allowed 'General case' 0 CA--C 1.511 -0.543 0 O-C-N 123.483 0.49 . . . . 0.0 110.136 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 151' ' ' THR . . . . . 0.552 ' C ' ' O ' ' B' ' 150' ' ' ALA . 11.2 m -5.19 111.43 0.03 OUTLIER Pre-proline 0 N--CA 1.471 0.624 0 O-C-N 124.827 1.329 . . . . 0.0 111.07 -179.301 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -45.55 -42.43 18.46 Favored 'Trans proline' 0 C--N 1.307 -1.634 0 C-N-CA 122.26 1.973 . . . . 0.0 112.686 -177.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 73.0 m -58.02 -45.89 86.18 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.53 -179.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 92.9 mtt180 -68.17 -37.08 80.6 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.191 0.519 . . . . 0.0 110.251 179.55 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 155' ' ' LEU . . . . . 0.473 ' O ' HD13 ' B' ' 155' ' ' LEU . 0.2 OUTLIER -59.86 -52.88 63.55 Favored 'General case' 0 C--N 1.32 -0.703 0 C-N-CA 120.032 -0.667 . . . . 0.0 111.009 -178.155 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 65.5 ttp -62.83 -44.13 96.96 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.706 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 80.3 mt -60.38 -44.58 96.34 Favored 'Isoleucine or valine' 0 C--O 1.241 0.636 0 CA-C-O 121.478 0.656 . . . . 0.0 110.465 -179.144 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -63.38 -39.81 95.53 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.662 179.335 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 25.0 m -57.94 -39.89 79.16 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.725 179.594 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 98.9 mm-40 -61.71 -45.1 95.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.236 179.721 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 161' ' ' LEU . . . . . 0.431 ' O ' ' N ' ' B' ' 164' ' ' GLY . 21.8 mt -62.8 -43.13 99.62 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 120.442 -0.503 . . . . 0.0 111.256 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 162' ' ' ARG . . . . . 0.501 HH21 ' CG ' ' B' ' 218' ' ' ASP . 78.9 ttt-85 -40.46 -30.15 0.1 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.736 -179.834 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 82.3 m-20 -60.48 -42.66 96.71 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.293 -179.333 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 164' ' ' GLY . . . . . 0.431 ' N ' ' O ' ' B' ' 161' ' ' LEU . . . 127.57 -114.89 2.0 Favored Glycine 0 CA--C 1.538 1.469 0 N-CA-C 111.191 -0.764 . . . . 0.0 111.191 179.252 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -75.8 129.09 11.34 Favored 'Trans proline' 0 N--CA 1.494 1.552 0 C-N-CA 122.4 2.067 . . . . 0.0 112.331 -179.537 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -175.91 84.14 0.29 Allowed Pre-proline 0 C--N 1.327 -0.394 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.242 179.457 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 55.1 Cg_exo -48.1 171.79 0.05 OUTLIER 'Trans proline' 0 C--N 1.305 -1.72 0 C-N-CA 122.756 2.304 . . . . 0.0 112.3 -179.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . 72.3 t -55.26 -44.96 77.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.317 -179.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 169' ' ' THR . . . . . . . . . . . . . 13.2 m -62.36 -44.46 96.42 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.367 179.18 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 64.3 t0 -63.3 -39.92 95.9 Favored 'General case' 0 C--O 1.24 0.553 0 CA-C-O 121.433 0.635 . . . . 0.0 110.162 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 171' ' ' LEU . . . . . 0.61 HD23 ' O ' ' B' ' 171' ' ' LEU . 4.5 tt -62.12 -43.91 97.81 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.81 -179.665 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 172' ' ' ALA . . . . . 0.577 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -59.42 -43.94 92.98 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 179.717 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 82.2 tt0 -54.46 -46.78 73.38 Favored 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 120.615 -0.434 . . . . 0.0 109.996 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -58.7 -50.76 72.7 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 120.683 -0.407 . . . . 0.0 110.693 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 93.8 mt -83.97 -73.53 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.102 179.617 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 176' ' ' GLY . . . . . 0.577 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 131.34 77.9 0.16 Allowed Glycine 0 C--N 1.332 0.309 0 N-CA-C 111.567 -0.613 . . . . 0.0 111.567 179.429 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 177' ' ' MET . . . . . 0.456 ' CB ' ' O ' ' B' ' 176' ' ' GLY . 23.9 ttm 79.94 99.39 0.06 Allowed 'General case' 0 C--O 1.233 0.229 0 C-N-CA 120.801 -0.36 . . . . 0.0 111.01 178.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 178' ' ' GLU . . . . . 0.424 ' OE1' ' O ' ' B' ' 177' ' ' MET . 1.3 tp10 179.45 22.97 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.18 179.632 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 51.2 mt-30 -57.82 -27.12 62.88 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 120.897 0.38 . . . . 0.0 111.027 -179.124 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 69.6 m -70.41 -45.99 64.84 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.159 179.844 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -63.47 -29.28 70.59 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.119 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 84.4 t -72.51 -52.41 23.67 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.305 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.45 179.669 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 9.5 t -55.12 -43.13 73.8 Favored 'General case' 0 C--N 1.32 -0.701 0 C-N-CA 120.282 -0.567 . . . . 0.0 110.614 -179.52 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 -69.98 -49.63 49.78 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.329 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 68.4 tp60 -59.02 -45.34 90.96 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.016 0.436 . . . . 0.0 110.652 -179.195 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -63.57 -40.36 96.77 Favored 'General case' 0 CA--C 1.502 -0.893 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.32 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 72.9 ttt180 -58.43 -43.75 88.86 Favored 'General case' 0 C--N 1.304 -1.394 0 C-N-CA 120.08 -0.648 . . . . 0.0 110.242 179.41 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 84.0 t -67.49 -53.5 31.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.169 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.102 179.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 189' ' ' LEU . . . . . 0.589 ' O ' ' N ' ' B' ' 193' ' ' GLY . 94.6 mt -57.73 -38.45 75.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.27 0.557 . . . . 0.0 109.741 -179.513 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 8.9 mmm180 -59.72 -44.13 93.87 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.302 179.72 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 191' ' ' ASN . . . . . 0.443 ' CB ' HD23 ' B' ' 192' ' ' LEU . 87.8 m-20 -64.42 -42.86 95.81 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.424 -0.51 . . . . 0.0 110.261 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 192' ' ' LEU . . . . . 0.443 HD23 ' CB ' ' B' ' 191' ' ' ASN . 0.4 OUTLIER -154.78 74.56 0.94 Allowed 'General case' 0 C--O 1.23 0.065 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.692 179.292 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 193' ' ' GLY . . . . . 0.589 ' N ' ' O ' ' B' ' 189' ' ' LEU . . . -148.38 0.73 0.59 Allowed Glycine 0 N--CA 1.463 0.471 0 N-CA-C 110.921 -0.872 . . . . 0.0 110.921 -179.648 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 194' ' ' LEU . . . . . 0.602 HD22 ' N ' ' B' ' 194' ' ' LEU . 3.7 mm? 56.28 60.44 3.16 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.814 0.34 . . . . 0.0 110.869 179.585 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 34.4 m -131.82 154.72 40.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.205 179.232 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 196' ' ' VAL . . . . . 0.468 HG12 ' N ' ' B' ' 197' ' ' GLY . 54.0 t -136.61 155.9 34.61 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.28 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.541 -179.379 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 197' ' ' GLY . . . . . 0.468 ' N ' HG12 ' B' ' 196' ' ' VAL . . . -145.67 158.74 27.76 Favored Glycine 0 CA--C 1.521 0.426 0 N-CA-C 110.341 -1.103 . . . . 0.0 110.341 179.718 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -113.7 114.33 26.23 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 120.941 0.4 . . . . 0.0 110.677 -179.807 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 62.4 ttp180 -86.37 134.12 33.74 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.28 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 200' ' ' ALA . . . . . . . . . . . . . . . -150.17 112.74 4.72 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.456 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 201' ' ' GLY . . . . . . . . . . . . . . . 47.57 -112.7 1.09 Allowed Glycine 0 CA--C 1.524 0.653 0 N-CA-C 110.46 -1.056 . . . . 0.0 110.46 -179.754 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 202' ' ' ARG . . . . . . . . . . . . . 20.2 mmm180 -110.13 42.59 1.51 Allowed 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 120.775 0.321 . . . . 0.0 110.415 179.668 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 41.5 t -153.15 122.53 6.69 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.566 179.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 1.4 tp -122.84 127.29 74.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 179.399 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 83.2 t -100.5 129.63 51.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.901 179.018 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 98.9 m-85 -105.45 130.66 53.48 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.557 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 69.9 m -150.82 171.52 17.09 Favored 'General case' 0 C--O 1.227 -0.12 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . 41.1 mt -79.04 147.44 32.84 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.535 -179.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 209' ' ' TYR . . . . . 0.435 ' CD2' ' CG2' ' B' ' 196' ' ' VAL . 5.9 t80 -55.66 -48.48 74.96 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.715 -0.394 . . . . 0.0 110.348 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 80.4 m-20 -124.74 -178.54 4.18 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 -179.716 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 66.6 p -104.02 -2.68 25.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.362 -179.771 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 212' ' ' HIS . . . . . 0.519 ' CE1' ' CD2' ' A' ' 104' ' ' HIS . 65.5 m80 -52.62 -54.98 25.73 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.332 -179.769 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 213' ' ' VAL . . . . . 0.509 ' HA ' HD21 ' B' ' 216' ' ' LEU . 10.6 t -44.67 -40.01 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 121.039 0.447 . . . . 0.0 110.282 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 214' ' ' ALA . . . . . . . . . . . . . . . -71.61 -36.75 70.89 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.906 179.547 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 97.5 mm-40 -64.24 -53.76 43.99 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.227 0.537 . . . . 0.0 111.223 -178.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 216' ' ' LEU . . . . . 0.509 HD21 ' HA ' ' B' ' 213' ' ' VAL . 3.1 pp -67.29 -40.08 86.07 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.621 -179.846 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 217' ' ' LEU . . . . . 0.453 ' HG ' HD13 ' B' ' 221' ' ' ILE . 6.3 tt -65.05 -42.33 94.35 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.467 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 218' ' ' ASP . . . . . 0.501 ' CG ' HH21 ' B' ' 162' ' ' ARG . 93.5 m-20 -61.13 -37.9 84.47 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.027 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 219' ' ' GLU . . . . . 0.424 ' OE2' ' OE2' ' A' ' 100' ' ' GLU . 97.2 mt-10 -71.79 -42.59 66.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.854 179.194 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -65.71 -49.37 68.73 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.006 0.432 . . . . 0.0 110.642 -179.747 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 221' ' ' ILE . . . . . 0.453 HD13 ' HG ' ' B' ' 217' ' ' LEU . 1.3 mp -63.99 -43.02 97.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.331 179.613 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 89.1 t80 -60.37 -48.12 83.1 Favored 'General case' 0 C--N 1.314 -0.952 0 C-N-CA 120.609 -0.437 . . . . 0.0 110.939 -179.28 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 223' ' ' HIS . . . . . 0.572 ' CD2' ' CE1' ' A' ' 93' ' ' HIS . 12.0 t-160 -67.07 -35.15 79.19 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.15 179.759 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 23.3 t -74.18 -50.29 19.9 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.952 0.406 . . . . 0.0 111.336 -179.692 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 71.9 mm-40 -66.73 -22.01 66.06 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.673 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 10.5 t60 -50.92 -69.49 0.11 Allowed 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 120.664 -0.415 . . . . 0.0 110.487 -179.221 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 227' ' ' LEU . . . . . . . . . . . . . 72.4 mt -76.78 -57.62 3.75 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.759 -179.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 228' ' ' HIS . . . . . . . . . . . . . 63.7 t-80 43.11 86.37 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.803 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 229' ' ' LEU . . . . . . . . . . . . . 95.1 mt -63.02 -42.82 99.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.477 -179.832 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . 76.43 3.72 78.25 Favored Glycine 0 N--CA 1.453 -0.176 0 N-CA-C 110.826 -0.909 . . . . 0.0 110.826 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 231' ' ' LEU . . . . . 0.596 HD13 ' N ' ' B' ' 232' ' ' SER . 0.2 OUTLIER -113.61 117.45 31.64 Favored 'General case' 0 N--CA 1.461 0.098 0 CA-C-O 120.807 0.336 . . . . 0.0 110.239 -179.727 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 232' ' ' SER . . . . . 0.596 ' N ' HD13 ' B' ' 231' ' ' LEU . 48.5 t -155.83 165.57 36.09 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.473 179.412 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 233' ' ' ASP . . . . . 0.434 ' O ' ' OD1' ' B' ' 233' ' ' ASP . 49.6 p-10 -90.36 89.01 7.42 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.635 179.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 234' ' ' ARG . . . . . . . . . . . . . 79.8 mmt-85 -78.29 148.4 33.87 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.545 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 235' ' ' HIS . . . . . . . . . . . . . 2.4 p-80 -155.25 152.42 24.9 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.592 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 236' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -67.03 -72.42 0.02 OUTLIER 'Trans proline' 0 N--CA 1.495 1.569 0 C-N-CA 122.598 2.198 . . . . 0.0 112.021 179.65 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 237' ' ' SER . . . . . . . . . . . . . 25.8 p -79.68 160.19 26.4 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.64 -179.709 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 238' ' ' ALA . . . . . . . . . . . . . . . -71.58 142.7 50.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.559 179.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.772 0 CA-C-O 118.031 -1.427 . . . . 0.0 110.972 179.964 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.289 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 79.2 m80 -79.61 135.87 36.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.73 0.3 . . . . 0.0 110.541 -179.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . 0.573 ' C ' ' H ' ' A' ' 6' ' ' GLU . . . 164.0 -105.19 0.25 Allowed Glycine 0 CA--C 1.517 0.219 0 N-CA-C 110.966 -0.854 . . . . 0.0 110.966 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER 69.99 -22.86 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 CA-C-O 120.781 0.324 . . . . 0.0 110.524 -179.593 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.573 ' H ' ' C ' ' A' ' 4' ' ' GLY . 97.9 mt-10 -75.46 155.48 36.21 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.764 -177.17 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 88.68 53.63 2.54 Favored Glycine 0 CA--C 1.525 0.667 0 N-CA-C 111.044 -0.822 . . . . 0.0 111.044 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 90.6 mtm-85 -63.19 -41.84 99.26 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.691 0.282 . . . . 0.0 110.532 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.433 ' O ' ' O ' ' A' ' 10' ' ' ARG . 51.5 p30 -115.86 31.59 6.62 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.552 179.823 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.433 ' O ' ' O ' ' A' ' 9' ' ' ASN . 27.5 mmt180 59.15 147.58 0.07 OUTLIER Pre-proline 0 N--CA 1.448 -0.56 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.89 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_exo -45.65 133.16 13.35 Favored 'Trans proline' 0 C--N 1.309 -1.534 0 C-N-CA 122.398 2.065 . . . . 0.0 112.248 179.642 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 98.9 p -96.87 0.0 48.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.59 179.747 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -166.64 149.34 6.09 Favored Pre-proline 0 C--N 1.324 -0.506 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.868 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -68.58 88.56 0.42 Allowed 'Trans proline' 0 C--N 1.309 -1.541 0 C-N-CA 122.569 2.179 . . . . 0.0 112.077 179.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 55.1 mt -62.79 -173.51 0.05 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.513 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.43 ' O ' ' HB3' ' A' ' 19' ' ' ALA . 30.8 m-20 -95.19 -31.09 13.68 Favored 'General case' 0 C--O 1.245 0.82 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.678 179.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 10.2 t -53.64 -57.71 9.79 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.387 -178.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 17.2 mp0 -44.98 -47.46 11.46 Favored 'General case' 0 C--O 1.21 -0.992 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 179.291 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.43 ' HB3' ' O ' ' A' ' 16' ' ' ASP . . . -50.58 -56.45 11.65 Favored 'General case' 0 C--O 1.242 0.664 0 C-N-CA 120.425 -0.51 . . . . 0.0 110.008 -178.49 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.17 -53.5 48.34 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.756 179.453 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -51.3 -47.64 62.53 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.778 -179.439 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 70.8 tp60 -54.48 -51.98 63.35 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-O 120.921 0.391 . . . . 0.0 110.274 -179.266 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 88.8 t -64.34 -47.53 89.22 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.53 179.779 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.04 -44.87 83.35 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.092 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 11.3 t -56.05 -42.78 77.13 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 26.3 m -60.11 -50.33 74.14 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.476 179.424 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.467 ' N ' ' CD1' ' A' ' 27' ' ' LEU . 7.2 mp -68.06 -23.21 64.93 Favored 'General case' 0 CA--C 1.522 -0.128 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.572 179.214 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.5 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 52.7 tt0 -70.89 -66.81 0.56 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.321 -179.707 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.62 -53.54 57.18 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.882 0.372 . . . . 0.0 110.438 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.503 ' O ' ' O ' ' A' ' 31' ' ' ALA . 46.3 tp -45.2 -28.41 0.77 Allowed 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.631 -179.5 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.503 ' O ' ' O ' ' A' ' 30' ' ' LEU . . . -56.22 -124.4 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.29 179.387 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.464 ' O ' ' O ' ' A' ' 31' ' ' ALA . 85.5 m 55.77 111.26 0.02 OUTLIER Pre-proline 0 C--N 1.324 -0.516 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.319 179.263 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -48.42 -47.99 18.51 Favored 'Trans proline' 0 C--N 1.305 -1.715 0 C-N-CA 122.496 2.131 . . . . 0.0 112.605 -178.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 65.1 m -62.09 -46.62 88.29 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.174 -179.058 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 53.1 ttm-85 -61.21 -45.25 95.36 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.699 -178.512 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.564 HD23 ' O ' ' A' ' 36' ' ' LEU . 1.4 tt -59.97 -52.78 63.94 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.666 -0.414 . . . . 0.0 110.343 -178.653 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 11.3 tpt -51.24 -47.79 62.29 Favored 'General case' 0 C--O 1.238 0.475 0 C-N-CA 120.63 -0.428 . . . . 0.0 110.035 -179.727 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 35.4 mm -63.34 -43.09 98.43 Favored 'Isoleucine or valine' 0 C--O 1.246 0.883 0 CA-C-O 121.101 0.477 . . . . 0.0 110.652 179.461 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.572 HD13 ' O ' ' A' ' 39' ' ' LEU . 0.2 OUTLIER -62.46 -43.7 98.19 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.758 -179.422 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 19.3 m -58.29 -40.46 82.0 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.913 179.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 60.7 tp60 -58.0 -45.55 86.67 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.113 179.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.416 HD22 ' O ' ' A' ' 87' ' ' TYR . 11.4 mt -65.42 -39.21 91.86 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.255 178.105 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 3.4 tmt_? -53.64 -46.07 70.4 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.583 -178.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 29.2 t-20 -61.44 -38.79 88.45 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.994 0.426 . . . . 0.0 110.226 179.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.401 ' O ' HD12 ' A' ' 47' ' ' LEU . . . -173.55 157.11 25.4 Favored Glycine 0 CA--C 1.527 0.8 0 N-CA-C 111.074 -0.811 . . . . 0.0 111.074 179.511 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.446 ' O ' ' O ' ' A' ' 47' ' ' LEU . 51.9 Cg_endo -71.34 -74.58 0.01 OUTLIER 'Trans proline' 0 C--N 1.31 -1.49 0 C-N-CA 122.727 2.285 . . . . 0.0 112.697 179.769 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.446 ' O ' ' O ' ' A' ' 46' ' ' PRO . 0.5 OUTLIER 59.57 144.59 0.05 OUTLIER Pre-proline 0 C--N 1.321 -0.643 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.022 178.306 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -67.54 167.28 21.25 Favored 'Trans proline' 0 C--N 1.305 -1.712 0 C-N-CA 122.554 2.169 . . . . 0.0 111.877 178.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.81 HG12 ' OE1' ' A' ' 60' ' ' GLN . 66.9 t -58.69 -41.77 83.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.131 -179.925 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.424 ' H ' HG22 ' A' ' 50' ' ' THR . 0.0 OUTLIER -60.28 -41.5 93.47 Favored 'General case' 0 C--O 1.248 0.991 0 CA-C-O 121.471 0.653 . . . . 0.0 110.69 179.78 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -64.96 -38.66 91.69 Favored 'General case' 0 C--O 1.239 0.551 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.04 179.664 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 17.9 mt -62.44 -35.23 78.63 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.342 179.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.495 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -60.96 -46.33 91.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.785 178.678 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 70.3 mm-40 -57.61 -47.95 80.75 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 120.484 -0.487 . . . . 0.0 110.28 179.751 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.14 -44.58 88.16 Favored 'General case' 0 C--O 1.232 0.166 0 C-N-CA 120.718 -0.393 . . . . 0.0 110.447 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 97.4 mt -97.62 -80.05 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.461 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . 0.495 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 156.94 103.19 0.2 Allowed Glycine 0 CA--C 1.526 0.723 0 N-CA-C 110.767 -0.933 . . . . 0.0 110.767 -179.624 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.517 ' O ' ' NE2' ' A' ' 60' ' ' GLN . 70.2 mmm 43.3 -114.84 0.34 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.109 0.481 . . . . 0.0 110.471 179.723 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 50.33 13.17 0.11 Allowed 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.417 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.81 ' OE1' HG12 ' A' ' 49' ' ' VAL . 3.2 mm-40 -50.85 -29.59 12.21 Favored 'General case' 0 C--O 1.238 0.498 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.667 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 3.0 t -72.98 -33.88 66.11 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.298 179.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.5 -38.96 74.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.123 -178.583 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.458 HG23 ' N ' ' A' ' 64' ' ' SER . 12.5 m -71.06 -47.02 63.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.568 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.458 ' N ' HG23 ' A' ' 63' ' ' VAL . 11.0 t -58.16 -43.96 87.67 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 -179.7 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . 0.411 ' O ' HG23 ' A' ' 69' ' ' VAL . 86.4 t60 -64.61 -51.05 64.72 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.845 179.66 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -61.72 -39.84 92.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.6 179.771 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.3 tp -60.91 -43.56 98.38 Favored 'General case' 0 C--O 1.218 -0.596 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.038 -179.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 72.3 ttt180 -60.73 -42.23 96.89 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-O 120.829 0.347 . . . . 0.0 110.316 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.411 HG23 ' O ' ' A' ' 65' ' ' HIS . 85.7 t -59.97 -54.75 30.42 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 C-N-CA 120.446 -0.502 . . . . 0.0 110.132 -179.201 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.453 ' N ' HD22 ' A' ' 70' ' ' LEU . 4.3 mm? -64.12 -37.83 88.86 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.584 179.079 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 60.1 ttt85 -52.25 -41.7 63.04 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.121 -179.477 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 -56.86 -45.75 82.27 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 120.587 -0.445 . . . . 0.0 110.293 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.0 mt -67.83 -39.06 83.93 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 110.021 -0.363 . . . . 0.0 110.021 179.61 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 96.74 46.47 2.48 Favored Glycine 0 CA--C 1.52 0.364 0 N-CA-C 110.989 -0.845 . . . . 0.0 110.989 -179.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 5.0 tp -105.78 -9.21 17.36 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.91 0.386 . . . . 0.0 110.763 -179.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.9 m -135.65 160.22 39.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.508 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -153.59 174.63 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.91 -179.703 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -143.85 156.48 26.68 Favored Glycine 0 C--N 1.332 0.34 0 N-CA-C 110.825 -0.91 . . . . 0.0 110.825 179.169 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -123.89 137.13 54.69 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 120.768 0.318 . . . . 0.0 110.4 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 63.8 ttm-85 -89.25 135.28 33.66 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.509 179.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -151.56 133.84 15.27 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.62 179.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 47.45 -112.35 0.99 Allowed Glycine 0 CA--C 1.519 0.343 0 N-CA-C 110.862 -0.895 . . . . 0.0 110.862 179.717 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 84.9 mtp180 -119.56 29.73 7.45 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 120.678 0.275 . . . . 0.0 110.494 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 73.6 m -154.86 174.21 15.42 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 121.033 0.444 . . . . 0.0 110.296 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.783 HD11 ' CE2' ' A' ' 87' ' ' TYR . 1.2 pp -136.65 161.7 36.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.475 179.845 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.611 ' N ' HD12 ' A' ' 85' ' ' ILE . 3.3 m -122.86 128.51 75.24 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.767 178.747 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.783 ' CE2' HD11 ' A' ' 85' ' ' ILE . 71.7 m-85 -89.96 119.07 30.01 Favored 'General case' 0 C--O 1.22 -0.495 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.054 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 66.6 m -133.04 152.59 51.95 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-O 120.966 0.412 . . . . 0.0 110.385 -179.321 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 1.024 HD22 ' H ' ' A' ' 89' ' ' LEU . 0.5 OUTLIER -73.03 137.6 45.45 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.526 179.927 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 66.3 t80 -61.71 -50.31 72.94 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.736 -179.644 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 39.6 t0 -89.75 130.49 36.01 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.793 -179.717 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 11.8 m -93.45 -28.98 15.8 Favored 'General case' 0 C--O 1.244 0.777 0 CA-C-O 121.309 0.576 . . . . 0.0 110.389 179.345 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . 0.579 ' CG ' ' CD2' ' B' ' 223' ' ' HIS . 75.9 m80 -55.21 -46.06 75.9 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.122 179.817 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.554 HG13 ' N ' ' A' ' 95' ' ' ALA . 13.1 p -53.05 -44.21 50.27 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.203 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.554 ' N ' HG13 ' A' ' 94' ' ' VAL . . . -57.08 -37.2 71.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.065 179.124 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -64.06 -38.93 92.87 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-O 121.23 0.538 . . . . 0.0 110.175 179.304 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 50.2 mt -61.21 -44.55 97.1 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.248 179.791 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.43 HD22 ' N ' ' A' ' 98' ' ' LEU . 4.2 mm? -66.94 -37.06 83.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.832 178.52 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -57.51 -47.26 82.43 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.189 -179.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.457 ' OE2' ' OE2' ' B' ' 219' ' ' GLU . 97.7 mt-10 -69.87 -52.31 25.84 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.548 179.238 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.465 ' HB2' HD13 ' B' ' 216' ' ' LEU . . . -53.3 -46.82 69.53 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.519 -179.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 4.8 mm -62.52 -44.53 99.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.352 -179.377 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' TYR . . . . . 0.633 ' CE1' ' NE2' ' A' ' 107' ' ' HIS . 85.1 t80 -60.84 -46.89 88.78 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.989 0.423 . . . . 0.0 110.421 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . 0.55 ' CD2' ' CG ' ' B' ' 212' ' ' HIS . 18.3 t-80 -57.0 -39.73 75.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.614 -179.82 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 36.1 t -76.28 -40.35 51.96 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.161 179.647 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -56.78 -33.96 67.15 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.408 -179.213 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . 0.633 ' NE2' ' CE1' ' A' ' 103' ' ' TYR . 9.2 m-70 -80.62 -2.21 45.54 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.513 179.66 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.447 ' C ' HD13 ' A' ' 108' ' ' LEU . 0.2 OUTLIER -144.35 103.82 4.02 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.446 179.704 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . 0.46 ' ND1' ' C ' ' A' ' 109' ' ' HIS . 7.2 p80 -158.65 5.01 0.11 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.647 179.531 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.531 ' N ' HD12 ' A' ' 110' ' ' LEU . 10.8 mp -63.02 -42.2 99.75 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.418 -179.355 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -75.24 -59.67 3.54 Favored Glycine 0 CA--C 1.52 0.366 0 N-CA-C 110.9 -0.88 . . . . 0.0 110.9 -179.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 10.6 tp 38.53 75.45 0.07 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.81 0.338 . . . . 0.0 110.748 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 40.7 t -106.0 124.22 49.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.38 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -94.7 113.99 25.86 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.534 -179.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.492 ' O ' ' CG ' ' A' ' 116' ' ' HIS . 30.2 mmt180 -82.06 92.52 6.83 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.388 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . 0.492 ' CG ' ' O ' ' A' ' 115' ' ' ARG . 53.6 m-70 -160.11 56.22 0.81 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.45 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . 0.41 ' CD ' ' N ' ' A' ' 116' ' ' HIS . 49.0 Cg_endo -69.16 154.79 69.57 Favored 'Trans proline' 0 C--N 1.307 -1.643 0 C-N-CA 122.696 2.264 . . . . 0.0 112.154 179.871 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 35.5 p -156.76 163.12 39.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.54 179.589 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . 56.99 46.49 19.32 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.71 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.678 0 CA-C-O 117.983 -1.454 . . . . 0.0 110.943 -179.978 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.337 0 N-CA-C 109.532 -1.427 . . . . 0.0 109.532 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 80.4 m80 -79.42 139.27 37.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.854 0.359 . . . . 0.0 110.38 179.819 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 123' ' ' GLY . . . . . 0.538 ' C ' ' H ' ' B' ' 125' ' ' GLU . . . 161.24 -108.95 0.37 Allowed Glycine 0 C--O 1.227 -0.339 0 N-CA-C 110.959 -0.857 . . . . 0.0 110.959 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER 71.15 -21.76 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.231 0.129 0 CA-C-O 120.789 0.328 . . . . 0.0 110.551 -179.63 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 125' ' ' GLU . . . . . 0.538 ' H ' ' C ' ' B' ' 123' ' ' GLY . 96.5 mt-10 -77.05 157.11 31.31 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.717 -177.264 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 85.32 53.69 3.04 Favored Glycine 0 CA--C 1.524 0.608 0 N-CA-C 110.992 -0.843 . . . . 0.0 110.992 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 127' ' ' ARG . . . . . . . . . . . . . 89.5 mtm-85 -62.63 -41.63 99.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.68 0.276 . . . . 0.0 110.524 -179.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 128' ' ' ASN . . . . . 0.443 ' O ' ' O ' ' B' ' 129' ' ' ARG . 52.8 p-10 -115.01 32.42 6.05 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.594 179.923 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 129' ' ' ARG . . . . . 0.443 ' O ' ' O ' ' B' ' 128' ' ' ASN . 26.7 mmt180 58.98 148.01 0.07 OUTLIER Pre-proline 0 N--CA 1.447 -0.579 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.909 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -47.16 133.98 19.04 Favored 'Trans proline' 0 C--N 1.309 -1.538 0 C-N-CA 122.416 2.077 . . . . 0.0 112.229 179.537 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 87.7 p -96.92 0.93 49.8 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.703 179.856 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 132' ' ' ALA . . . . . . . . . . . . . . . -167.02 148.86 5.48 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.966 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 133' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -68.4 85.17 0.45 Allowed 'Trans proline' 0 C--N 1.309 -1.503 0 C-N-CA 122.57 2.18 . . . . 0.0 112.016 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 47.7 mt -58.82 -173.53 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.433 179.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 135' ' ' ASP . . . . . 0.424 ' O ' ' HB3' ' B' ' 138' ' ' ALA . 18.3 m-20 -95.92 -30.38 13.66 Favored 'General case' 0 C--O 1.247 0.927 0 CA-C-O 121.196 0.522 . . . . 0.0 110.725 179.768 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 10.0 t -54.07 -57.18 12.05 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.379 -178.64 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 14.0 mp0 -46.01 -47.27 16.82 Favored 'General case' 0 C--O 1.209 -1.038 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 179.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 138' ' ' ALA . . . . . 0.424 ' HB3' ' O ' ' B' ' 135' ' ' ASP . . . -50.04 -56.25 11.55 Favored 'General case' 0 C--O 1.242 0.706 0 C-N-CA 120.423 -0.511 . . . . 0.0 109.998 -178.348 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -64.5 -53.15 52.65 Favored 'General case' 0 N--CA 1.457 -0.108 0 C-N-CA 120.381 -0.528 . . . . 0.0 110.784 179.387 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -51.44 -46.13 62.9 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.875 -179.266 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 68.9 tp60 -55.75 -52.86 62.49 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 120.862 0.363 . . . . 0.0 110.171 -179.291 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 142' ' ' VAL . . . . . . . . . . . . . 90.4 t -63.51 -46.84 94.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.451 179.651 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -57.55 -45.75 84.74 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.394 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 11.3 t -56.07 -41.72 75.55 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 19.3 m -60.64 -49.05 79.06 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.358 179.647 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 146' ' ' LEU . . . . . 0.467 ' N ' ' CD1' ' B' ' 146' ' ' LEU . 7.3 mp -69.44 -22.33 63.67 Favored 'General case' 0 CA--C 1.522 -0.122 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.572 179.172 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 147' ' ' GLN . . . . . 0.525 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 54.4 tt0 -71.58 -66.04 0.68 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.195 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -59.17 -53.64 56.06 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.833 0.349 . . . . 0.0 110.321 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.52 ' O ' ' O ' ' B' ' 150' ' ' ALA . 39.0 tp -45.8 -29.45 1.34 Allowed 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.548 -179.703 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 150' ' ' ALA . . . . . 0.525 ' HB3' ' O ' ' B' ' 147' ' ' GLN . . . -55.46 -125.54 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.36 179.535 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 151' ' ' THR . . . . . 0.463 ' O ' ' O ' ' B' ' 150' ' ' ALA . 90.9 m 56.25 112.73 0.02 OUTLIER Pre-proline 0 N--CA 1.446 -0.633 0 CA-C-N 116.508 -0.314 . . . . 0.0 110.326 179.332 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -48.56 -49.14 15.32 Favored 'Trans proline' 0 C--N 1.305 -1.731 0 C-N-CA 122.47 2.113 . . . . 0.0 112.811 -179.284 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 46.0 m -61.49 -46.64 89.15 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.043 -178.748 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 54.0 ttm-85 -61.33 -44.88 96.45 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.669 -178.541 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 155' ' ' LEU . . . . . 0.581 HD23 ' O ' ' B' ' 155' ' ' LEU . 1.8 tt -60.47 -52.63 64.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.342 -178.594 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 11.3 tpt -51.17 -47.56 62.12 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 120.607 -0.437 . . . . 0.0 109.981 -179.59 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 35.5 mm -63.52 -42.67 96.98 Favored 'Isoleucine or valine' 0 C--O 1.247 0.967 0 CA-C-O 121.123 0.487 . . . . 0.0 110.636 179.216 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 158' ' ' LEU . . . . . 0.555 HD13 ' O ' ' B' ' 158' ' ' LEU . 0.2 OUTLIER -62.57 -42.84 99.8 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.796 -179.447 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 9.2 m -59.15 -41.92 89.5 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.786 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 60.2 tp60 -56.56 -45.77 81.1 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 121.002 0.429 . . . . 0.0 110.298 179.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 161' ' ' LEU . . . . . 0.438 HD22 ' O ' ' B' ' 206' ' ' TYR . 12.7 mt -65.7 -38.3 88.87 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.195 178.316 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 162' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -55.29 -44.27 75.57 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.581 -178.59 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -63.69 -39.24 93.83 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.233 179.214 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 164' ' ' GLY . . . . . 0.428 ' O ' HD12 ' B' ' 166' ' ' LEU . . . -172.66 155.53 23.3 Favored Glycine 0 CA--C 1.528 0.884 0 N-CA-C 111.111 -0.796 . . . . 0.0 111.111 179.547 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 165' ' ' PRO . . . . . 0.43 ' O ' ' O ' ' B' ' 166' ' ' LEU . 49.4 Cg_endo -70.74 -75.56 0.01 OUTLIER 'Trans proline' 0 C--N 1.31 -1.453 0 C-N-CA 122.761 2.307 . . . . 0.0 112.583 179.736 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 166' ' ' LEU . . . . . 0.43 ' O ' ' O ' ' B' ' 165' ' ' PRO . 0.4 OUTLIER 60.08 144.07 0.05 OUTLIER Pre-proline 0 C--N 1.32 -0.675 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.028 178.319 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -66.6 167.14 19.81 Favored 'Trans proline' 0 C--N 1.305 -1.757 0 C-N-CA 122.58 2.186 . . . . 0.0 112.127 179.504 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 168' ' ' VAL . . . . . 0.805 HG12 ' OE1' ' B' ' 179' ' ' GLN . 55.0 t -58.24 -41.93 82.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.897 -179.923 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 169' ' ' THR . . . . . 0.438 ' H ' HG22 ' B' ' 169' ' ' THR . 0.0 OUTLIER -60.2 -41.74 93.63 Favored 'General case' 0 C--O 1.247 0.931 0 CA-C-O 121.501 0.667 . . . . 0.0 110.701 179.69 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -64.5 -38.45 91.06 Favored 'General case' 0 C--O 1.239 0.527 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.127 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 18.9 mt -62.14 -36.1 80.78 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.356 179.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 172' ' ' ALA . . . . . 0.474 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -60.66 -46.27 90.98 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.922 178.936 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -57.76 -48.13 80.54 Favored 'General case' 0 C--O 1.236 0.342 0 C-N-CA 120.553 -0.459 . . . . 0.0 110.285 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -65.03 -45.57 84.88 Favored 'General case' 0 C--O 1.232 0.163 0 C-N-CA 120.696 -0.402 . . . . 0.0 110.633 179.712 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 97.0 mt -96.8 -79.08 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.604 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 176' ' ' GLY . . . . . 0.474 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 156.86 103.3 0.2 Allowed Glycine 0 CA--C 1.525 0.666 0 N-CA-C 110.74 -0.944 . . . . 0.0 110.74 -179.683 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 177' ' ' MET . . . . . 0.538 ' O ' ' NE2' ' B' ' 179' ' ' GLN . 74.7 mtp 41.35 -113.16 0.18 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.181 0.515 . . . . 0.0 110.578 179.823 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 50.09 11.9 0.07 Allowed 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.305 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 179' ' ' GLN . . . . . 0.805 ' OE1' HG12 ' B' ' 168' ' ' VAL . 2.7 mm-40 -48.74 -29.33 4.37 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.752 179.778 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 38.9 m -73.04 -33.93 65.99 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.307 179.704 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -70.02 -38.87 76.02 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.119 -178.734 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 182' ' ' VAL . . . . . 0.446 HG23 ' N ' ' B' ' 183' ' ' SER . 11.0 m -71.42 -47.19 60.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.483 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 183' ' ' SER . . . . . 0.446 ' N ' HG23 ' B' ' 182' ' ' VAL . 10.5 t -57.73 -44.1 85.77 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 184' ' ' HIS . . . . . 0.409 ' O ' HG23 ' B' ' 188' ' ' VAL . 86.1 t60 -65.58 -51.71 57.68 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.809 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -60.99 -41.54 96.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.534 179.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 7.5 tp -59.53 -44.21 93.26 Favored 'General case' 0 C--O 1.216 -0.665 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.201 -179.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 72.9 ttt180 -60.09 -42.64 95.07 Favored 'General case' 0 C--O 1.242 0.671 0 CA-C-O 120.991 0.424 . . . . 0.0 110.414 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 188' ' ' VAL . . . . . 0.409 HG23 ' O ' ' B' ' 184' ' ' HIS . 88.7 t -59.46 -54.46 34.08 Favored 'Isoleucine or valine' 0 C--O 1.232 0.135 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.012 -179.211 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 189' ' ' LEU . . . . . 0.456 ' N ' ' CD2' ' B' ' 189' ' ' LEU . 4.1 mm? -64.42 -38.08 89.78 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.572 178.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 61.2 ttt85 -51.23 -39.72 57.25 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.321 -179.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -60.36 -40.1 89.56 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.809 0.337 . . . . 0.0 110.237 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 192' ' ' LEU . . . . . 0.431 HD23 ' N ' ' B' ' 192' ' ' LEU . 7.4 mt -71.59 -37.72 70.96 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.489 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 95.19 42.5 3.73 Favored Glycine 0 CA--C 1.522 0.502 0 N-CA-C 110.766 -0.934 . . . . 0.0 110.766 -179.282 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 5.1 tp -103.99 -9.55 18.77 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.794 0.33 . . . . 0.0 110.921 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 195' ' ' VAL . . . . . 0.413 ' O ' HG13 ' B' ' 196' ' ' VAL . 3.4 m -135.71 159.78 39.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.659 -179.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 196' ' ' VAL . . . . . 0.413 HG13 ' O ' ' B' ' 195' ' ' VAL . 0.2 OUTLIER -155.2 176.39 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.823 -179.83 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 197' ' ' GLY . . . . . . . . . . . . . . . -145.47 158.3 27.61 Favored Glycine 0 CA--C 1.52 0.397 0 N-CA-C 110.723 -0.951 . . . . 0.0 110.723 179.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -124.19 137.98 54.47 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-O 120.673 0.273 . . . . 0.0 110.368 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 61.6 ttm-85 -90.21 133.46 34.9 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.466 179.754 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 200' ' ' ALA . . . . . . . . . . . . . . . -149.0 134.2 18.29 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.568 179.336 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 201' ' ' GLY . . . . . . . . . . . . . . . 46.0 -113.06 0.94 Allowed Glycine 0 CA--C 1.52 0.376 0 N-CA-C 110.809 -0.916 . . . . 0.0 110.809 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 202' ' ' ARG . . . . . . . . . . . . . 84.4 mtp180 -118.76 32.69 6.0 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 120.708 0.289 . . . . 0.0 110.416 179.856 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 64.2 m -156.99 173.18 17.41 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 121.135 0.493 . . . . 0.0 110.334 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 204' ' ' ILE . . . . . 0.756 HD11 ' CE2' ' B' ' 206' ' ' TYR . 1.1 pp -136.87 160.18 36.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.352 179.787 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 205' ' ' VAL . . . . . 0.643 ' N ' HD12 ' B' ' 204' ' ' ILE . 3.0 m -120.95 129.3 75.84 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.719 178.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 206' ' ' TYR . . . . . 0.756 ' CE2' HD11 ' B' ' 204' ' ' ILE . 71.9 m-85 -90.37 118.33 29.78 Favored 'General case' 0 C--O 1.219 -0.533 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.005 -179.776 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 63.7 m -133.46 152.68 51.94 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.013 0.435 . . . . 0.0 110.327 -179.309 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 208' ' ' LEU . . . . . 1.031 HD22 ' H ' ' B' ' 208' ' ' LEU . 0.5 OUTLIER -73.37 136.52 44.39 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.652 179.845 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 209' ' ' TYR . . . . . 0.407 ' H ' ' HA ' ' B' ' 195' ' ' VAL . 63.4 t80 -61.68 -47.65 84.36 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.554 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -90.29 129.36 36.53 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.695 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 23.6 m -94.02 -31.06 14.39 Favored 'General case' 0 C--O 1.244 0.808 0 CA-C-O 121.334 0.587 . . . . 0.0 110.304 179.43 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 212' ' ' HIS . . . . . 0.55 ' CG ' ' CD2' ' A' ' 104' ' ' HIS . 75.3 m80 -54.44 -45.09 73.0 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 115.89 -0.595 . . . . 0.0 109.995 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 213' ' ' VAL . . . . . 0.569 HG13 ' N ' ' B' ' 214' ' ' ALA . 13.1 p -52.82 -43.67 46.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.054 0.454 . . . . 0.0 110.124 179.836 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 214' ' ' ALA . . . . . 0.569 ' N ' HG13 ' B' ' 213' ' ' VAL . . . -57.69 -38.12 74.64 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.014 179.053 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 57.2 tt0 -62.72 -39.5 94.26 Favored 'General case' 0 C--O 1.238 0.459 0 CA-C-O 121.258 0.551 . . . . 0.0 110.119 179.318 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 216' ' ' LEU . . . . . 0.465 HD13 ' HB2' ' A' ' 101' ' ' ALA . 48.9 mt -61.38 -44.87 96.41 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.298 179.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 217' ' ' LEU . . . . . 0.401 ' N ' ' CD2' ' B' ' 217' ' ' LEU . 4.1 mm? -66.45 -37.3 84.84 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.886 178.383 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -57.59 -47.36 82.32 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.14 -179.042 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 219' ' ' GLU . . . . . 0.457 ' OE2' ' OE2' ' A' ' 100' ' ' GLU . 94.6 mt-10 -69.91 -51.5 32.49 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.607 179.185 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -53.64 -47.68 70.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.459 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 4.4 mm -62.07 -44.76 99.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.432 -179.251 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 222' ' ' TYR . . . . . 0.593 ' CE1' ' NE2' ' B' ' 226' ' ' HIS . 74.5 t80 -60.09 -47.37 86.16 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.943 0.402 . . . . 0.0 110.427 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 223' ' ' HIS . . . . . 0.579 ' CD2' ' CG ' ' A' ' 93' ' ' HIS . 17.7 t-80 -56.75 -39.24 73.64 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.586 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 32.9 t -76.74 -40.53 48.19 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.066 179.778 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 82.9 tt0 -56.78 -34.85 68.03 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.355 -179.254 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 226' ' ' HIS . . . . . 0.593 ' NE2' ' CE1' ' B' ' 222' ' ' TYR . 8.0 m-70 -80.21 -1.77 42.02 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.483 179.803 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 227' ' ' LEU . . . . . 0.481 HD22 ' HA ' ' B' ' 227' ' ' LEU . 0.2 OUTLIER -144.64 105.15 4.12 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.626 179.797 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 228' ' ' HIS . . . . . 0.455 ' C ' ' ND1' ' B' ' 228' ' ' HIS . 7.4 p80 -160.41 4.29 0.08 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.709 179.463 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 229' ' ' LEU . . . . . 0.536 ' N ' HD12 ' B' ' 229' ' ' LEU . 10.9 mp -62.09 -41.88 98.64 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.455 -179.397 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 230' ' ' GLY . . . . . 0.405 ' O ' ' C ' ' B' ' 231' ' ' LEU . . . -74.07 -57.43 4.8 Favored Glycine 0 CA--C 1.521 0.437 0 N-CA-C 110.865 -0.894 . . . . 0.0 110.865 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 231' ' ' LEU . . . . . 0.405 ' C ' ' O ' ' B' ' 230' ' ' GLY . 30.7 tp 38.08 72.35 0.13 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.802 0.334 . . . . 0.0 110.679 -179.844 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 232' ' ' SER . . . . . . . . . . . . . 31.4 t -104.1 121.66 43.69 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.916 0.389 . . . . 0.0 110.312 -179.379 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 233' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -94.44 116.96 29.41 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.535 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 234' ' ' ARG . . . . . 0.523 ' O ' ' CG ' ' B' ' 235' ' ' HIS . 30.2 mmt180 -85.2 93.7 8.72 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.47 -179.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 235' ' ' HIS . . . . . 0.523 ' CG ' ' O ' ' B' ' 234' ' ' ARG . 63.7 m-70 -160.81 57.18 0.84 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.528 179.836 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 236' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -70.35 155.32 64.24 Favored 'Trans proline' 0 C--N 1.307 -1.62 0 C-N-CA 122.86 2.374 . . . . 0.0 112.137 -179.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 237' ' ' SER . . . . . . . . . . . . . 35.7 p -156.84 164.54 37.96 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.606 179.563 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 238' ' ' ALA . . . . . . . . . . . . . . . 55.15 42.11 30.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.564 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.771 0 CA-C-O 118.012 -1.438 . . . . 0.0 110.906 179.979 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.392 0 N-CA-C 109.556 -1.418 . . . . 0.0 109.556 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.425 ' O ' ' ND1' ' A' ' 3' ' ' HIS . 10.3 p80 -155.55 148.48 24.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.83 0.348 . . . . 0.0 110.356 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 140.59 -37.41 1.68 Allowed Glycine 0 N--CA 1.462 0.431 0 N-CA-C 110.949 -0.861 . . . . 0.0 110.949 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 75.0 t -127.43 132.37 69.43 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 CA-C-O 120.925 0.393 . . . . 0.0 110.414 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 45.48 -165.94 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.472 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 79.92 22.3 64.01 Favored Glycine 0 CA--C 1.524 0.611 0 N-CA-C 111.013 -0.835 . . . . 0.0 111.013 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 37.5 mmt180 -75.65 100.24 4.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.026 0.441 . . . . 0.0 110.66 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.457 ' O ' ' O ' ' A' ' 10' ' ' ARG . 77.2 m-20 54.12 26.65 6.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.505 179.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.457 ' O ' ' O ' ' A' ' 9' ' ' ASN . 89.5 mtt180 56.74 151.16 0.06 OUTLIER Pre-proline 0 C--N 1.326 -0.424 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.832 179.597 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -67.41 144.76 68.86 Favored 'Trans proline' 0 N--CA 1.494 1.535 0 C-N-CA 122.511 2.141 . . . . 0.0 112.003 179.4 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.7 p -165.03 34.5 0.06 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.642 179.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -162.26 70.97 2.25 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.696 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -53.61 133.54 54.23 Favored 'Trans proline' 0 C--N 1.307 -1.637 0 C-N-CA 122.826 2.35 . . . . 0.0 111.772 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.527 ' O ' ' N ' ' A' ' 17' ' ' SER . 56.0 mt -85.48 174.01 9.81 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.443 179.928 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.523 ' O ' ' N ' ' A' ' 19' ' ' ALA . 98.9 m-20 -43.3 -16.82 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.722 179.76 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.527 ' N ' ' O ' ' A' ' 15' ' ' LEU . 91.3 p -38.31 -38.5 0.36 Allowed 'General case' 0 C--O 1.24 0.583 0 CA-C-O 121.231 0.539 . . . . 0.0 110.6 -179.509 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 25.1 pt20 -65.33 -44.02 89.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.328 179.144 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.544 ' O ' HG23 ' A' ' 23' ' ' VAL . . . -63.67 -28.6 70.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.202 179.456 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.36 -51.73 48.64 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.239 179.68 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.06 -46.5 89.36 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.71 179.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -54.48 -50.58 67.42 Favored 'General case' 0 C--O 1.241 0.648 0 CA-C-O 121.177 0.513 . . . . 0.0 110.471 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.544 HG23 ' O ' ' A' ' 19' ' ' ALA . 92.2 t -62.76 -44.73 99.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.42 179.573 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.554 ' HB1' ' N ' ' B' ' 151' ' ' THR . . . -53.6 -44.05 69.11 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 10.9 t -59.91 -43.88 94.6 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 11.1 m -63.73 -46.95 83.06 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.025 0.441 . . . . 0.0 110.39 179.289 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 95.4 mt -67.26 -21.12 65.73 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.643 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 58.2 tt0 -75.81 -56.36 4.75 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.637 179.329 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.12 -54.61 45.02 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.448 -179.466 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.486 ' O ' ' O ' ' A' ' 31' ' ' ALA . 93.3 mt -47.56 -41.96 22.56 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.557 -179.205 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.517 ' O ' ' CB ' ' A' ' 32' ' ' THR . . . -50.04 -174.97 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.017 179.752 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.544 ' N ' ' HB1' ' B' ' 143' ' ' ALA . 1.0 OUTLIER 88.37 118.3 0.03 OUTLIER Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.031 179.961 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -46.7 -46.58 17.69 Favored 'Trans proline' 0 N--CA 1.496 1.659 0 C-N-CA 122.368 2.045 . . . . 0.0 113.113 -178.662 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 11.6 t -58.97 -44.5 91.55 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.813 -179.118 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 22.5 mmt85 -62.0 -46.15 90.46 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 120.675 -0.41 . . . . 0.0 110.984 -179.315 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.467 ' CD2' ' O ' ' A' ' 30' ' ' LEU . 4.2 mm? -62.87 -47.31 83.88 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.974 -179.567 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.5 ' SD ' HD11 ' A' ' 56' ' ' ILE . 14.3 tmm? -58.32 -49.22 77.97 Favored 'General case' 0 C--N 1.32 -0.677 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.545 -179.673 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 32.9 mm -63.96 -44.62 97.96 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.789 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 49.3 mt -62.12 -42.35 99.14 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.754 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 19.5 m -60.16 -41.32 92.56 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.2 -0.455 . . . . 0.0 109.896 179.554 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.539 ' N ' ' OE1' ' A' ' 41' ' ' GLN . 0.1 OUTLIER -57.85 -49.68 75.86 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.262 -0.426 . . . . 0.0 109.928 179.992 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 98.3 mt -63.77 -42.55 97.76 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.455 -0.498 . . . . 0.0 110.685 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 72.7 ttp85 -71.53 -21.12 61.95 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.646 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 62.0 t-20 -62.46 -41.22 98.61 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.934 0.397 . . . . 0.0 110.48 -179.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 159.34 -166.59 34.78 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 111.088 -0.805 . . . . 0.0 111.088 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_exo -73.51 115.51 4.36 Favored 'Trans proline' 0 N--CA 1.492 1.415 0 C-N-CA 122.888 2.392 . . . . 0.0 112.151 179.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.449 ' O ' ' O ' ' A' ' 48' ' ' PRO . 0.3 OUTLIER -158.34 84.61 2.58 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.106 179.911 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . 0.449 ' O ' ' O ' ' A' ' 47' ' ' LEU . 51.2 Cg_exo -51.14 -166.57 0.0 OUTLIER 'Trans proline' 0 C--N 1.303 -1.855 0 C-N-CA 122.471 2.114 . . . . 0.0 112.385 179.699 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 55.0 t -59.69 -51.06 77.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 121.072 0.463 . . . . 0.0 111.291 -179.265 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.423 HG22 ' H ' ' A' ' 50' ' ' THR . 0.1 OUTLIER -57.33 -44.84 84.57 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.257 0.551 . . . . 0.0 109.921 179.957 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 -65.09 -33.99 77.34 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.592 -0.522 . . . . 0.0 109.592 179.429 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.591 ' O ' HD13 ' A' ' 52' ' ' LEU . 0.2 OUTLIER -62.05 -43.26 99.21 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 120.541 -0.463 . . . . 0.0 110.09 -179.777 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.81 -45.04 96.01 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.587 179.407 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 41.1 tp10 -65.03 -30.42 71.4 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.369 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -70.28 -53.98 14.56 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.853 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.5 HD11 ' SD ' ' A' ' 37' ' ' MET . 90.2 mt -94.26 -68.67 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.247 179.858 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 134.2 97.72 0.6 Allowed Glycine 0 C--N 1.332 0.322 0 N-CA-C 111.348 -0.701 . . . . 0.0 111.348 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 65.6 mtt 60.02 97.38 0.03 OUTLIER 'General case' 0 CA--C 1.519 -0.212 0 C-N-CA 120.819 -0.352 . . . . 0.0 110.928 178.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -179.6 19.15 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.488 179.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 56.0 mt-30 -54.4 -26.72 32.16 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.365 0.602 . . . . 0.0 110.797 -179.047 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 78.1 p -74.39 -31.48 62.36 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.237 179.353 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -74.6 -38.98 62.46 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.446 -178.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.599 HG13 ' N ' ' A' ' 64' ' ' SER . 7.6 p -73.81 -50.63 28.21 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 CA-C-N 116.515 -0.312 . . . . 0.0 110.381 179.898 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.599 ' N ' HG13 ' A' ' 63' ' ' VAL . 45.4 t -58.37 -43.76 88.58 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 120.509 -0.477 . . . . 0.0 110.362 -179.787 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . 0.472 ' O ' HG23 ' A' ' 69' ' ' VAL . 55.6 t-80 -67.0 -45.55 77.24 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.859 179.686 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -63.86 -48.49 76.51 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.974 -179.192 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -61.84 -44.55 96.62 Favored 'General case' 0 CA--C 1.503 -0.829 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.877 -179.343 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 60.8 ttp180 -59.55 -44.35 93.27 Favored 'General case' 0 C--N 1.315 -0.891 0 CA-C-O 121.059 0.457 . . . . 0.0 110.377 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.472 HG23 ' O ' ' A' ' 65' ' ' HIS . 47.9 t -59.24 -51.83 67.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 C-N-CA 120.344 -0.542 . . . . 0.0 110.055 -179.85 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 95.6 mt -67.9 -27.68 66.85 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.976 0.417 . . . . 0.0 110.467 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 74.2 ttt180 -62.31 -42.43 99.36 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.408 -179.695 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 -60.56 -44.52 96.08 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 120.599 -0.441 . . . . 0.0 110.357 -179.672 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 10.2 mt -65.3 -39.01 91.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.318 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 99.4 60.05 0.87 Allowed Glycine 0 N--CA 1.462 0.403 0 N-CA-C 110.717 -0.953 . . . . 0.0 110.717 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 27.9 tp -118.53 -15.91 9.55 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 121.006 0.431 . . . . 0.0 110.352 -179.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 21.2 m -131.37 163.64 36.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.087 0.47 . . . . 0.0 110.281 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.582 HG12 ' N ' ' A' ' 78' ' ' GLY . 91.9 t -143.62 163.22 15.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.803 -179.481 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.582 ' N ' HG12 ' A' ' 77' ' ' VAL . . . -108.56 161.24 13.35 Favored Glycine 0 CA--C 1.524 0.597 0 N-CA-C 110.584 -1.006 . . . . 0.0 110.584 179.606 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -142.02 111.25 6.41 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.761 0.315 . . . . 0.0 110.568 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 73.8 ttp85 -75.07 128.43 35.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.587 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.434 ' O ' ' O ' ' A' ' 84' ' ' SER . . . -171.56 142.99 1.69 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.588 179.816 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 53.06 46.88 61.25 Favored Glycine 0 CA--C 1.525 0.665 0 N-CA-C 110.966 -0.854 . . . . 0.0 110.966 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 83.6 mtp180 50.42 29.29 3.81 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.77 0.319 . . . . 0.0 110.75 -179.735 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . 0.434 ' O ' ' O ' ' A' ' 81' ' ' ALA . 29.8 t -153.03 139.96 19.14 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-O 121.023 0.44 . . . . 0.0 110.09 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.766 HD11 ' CE2' ' A' ' 87' ' ' TYR . 1.2 pp -92.69 148.01 4.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.293 179.901 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 70.2 t -122.38 134.23 66.23 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.26 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.064 179.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.766 ' CE2' HD11 ' A' ' 85' ' ' ILE . 64.4 m-85 -90.93 124.6 35.33 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.387 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 65.5 m -138.67 158.79 43.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.516 -179.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 18.2 mt -66.88 140.47 57.79 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.315 -179.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.405 ' CD1' ' C ' ' A' ' 90' ' ' TYR . 14.5 t80 -57.12 -50.7 71.98 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.642 -179.76 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -100.98 134.27 44.22 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.879 0.371 . . . . 0.0 110.608 -179.486 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 70.8 p -74.26 -26.66 60.34 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.363 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 74.0 m80 -56.36 -43.69 79.38 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.338 -179.772 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 75.0 t -56.94 -43.06 79.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -179.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.37 -43.03 99.57 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.252 179.497 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 68.1 tp60 -64.34 -42.59 96.18 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.177 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 12.6 tp -59.02 -43.66 91.61 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.964 -179.373 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 90.4 mt -64.34 -39.71 94.44 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.191 179.444 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -58.92 -42.39 89.56 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.437 -179.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -66.16 -53.71 34.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.514 179.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.95 -41.06 86.54 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.021 0.438 . . . . 0.0 110.49 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 4.0 mm -61.63 -44.58 98.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.519 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' TYR . . . . . 0.508 ' O ' ' ND1' ' A' ' 107' ' ' HIS . 4.0 m-85 -66.21 -38.29 87.61 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.139 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 3.8 t60 -58.64 -42.81 89.19 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.589 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 29.8 t -79.45 -36.61 38.58 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.036 0.446 . . . . 0.0 111.22 179.386 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 48.1 tp10 -55.68 -40.77 72.76 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.433 -178.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . 0.508 ' ND1' ' O ' ' A' ' 103' ' ' TYR . 36.0 m80 -49.85 -70.43 0.09 Allowed 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 -179.196 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.52 HD23 ' N ' ' A' ' 109' ' ' HIS . 1.8 tt -177.93 112.93 0.08 Allowed 'General case' 0 C--N 1.328 -0.362 0 O-C-N 123.336 0.397 . . . . 0.0 110.404 179.383 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . 0.52 ' N ' HD23 ' A' ' 108' ' ' LEU . 47.4 t-80 -156.49 100.71 1.97 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.7 179.527 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 95.4 mt -63.29 -41.79 99.01 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.433 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 45.7 76.36 0.13 Allowed Glycine 0 CA--C 1.52 0.363 0 N-CA-C 111.058 -0.817 . . . . 0.0 111.058 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 44.5 tp -79.93 127.25 32.04 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.851 -0.34 . . . . 0.0 110.485 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 9.8 p -74.99 147.57 40.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.686 179.568 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 91.5 m-20 -98.47 1.02 46.31 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.536 179.705 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 95.7 mtt-85 -65.6 -101.77 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.674 -179.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 11.3 m-70 43.63 71.6 1.42 Allowed Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.515 -179.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -58.9 144.85 98.65 Favored 'Trans proline' 0 C--N 1.306 -1.666 0 C-N-CA 122.724 2.283 . . . . 0.0 111.805 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 65.7 m -116.96 121.82 42.49 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.638 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -70.22 143.46 52.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.372 179.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.703 0 CA-C-O 118.031 -1.427 . . . . 0.0 110.991 -179.932 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.233 0 N-CA-C 109.46 -1.456 . . . . 0.0 109.46 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 13.6 p80 -151.48 150.91 30.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.801 0.334 . . . . 0.0 110.331 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 123' ' ' GLY . . . . . . . . . . . . . . . 139.09 -35.54 1.97 Allowed Glycine 0 CA--C 1.521 0.453 0 N-CA-C 110.934 -0.867 . . . . 0.0 110.934 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 124' ' ' VAL . . . . . 0.418 ' O ' ' O ' ' B' ' 125' ' ' GLU . 79.5 t -128.37 134.56 64.56 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 CA-C-O 120.903 0.382 . . . . 0.0 110.381 -179.802 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 125' ' ' GLU . . . . . 0.418 ' O ' ' O ' ' B' ' 124' ' ' VAL . 97.3 mt-10 42.9 -166.57 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.618 179.704 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 80.64 21.4 64.06 Favored Glycine 0 CA--C 1.524 0.648 0 N-CA-C 110.936 -0.866 . . . . 0.0 110.936 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 127' ' ' ARG . . . . . . . . . . . . . 35.9 mmt180 -73.38 100.7 3.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.84 0.353 . . . . 0.0 110.719 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 128' ' ' ASN . . . . . 0.478 ' O ' ' O ' ' B' ' 129' ' ' ARG . 82.9 m-20 53.94 27.31 7.17 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.607 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 129' ' ' ARG . . . . . 0.478 ' O ' ' O ' ' B' ' 128' ' ' ASN . 86.3 mtt180 56.01 150.63 0.06 OUTLIER Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.982 179.751 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo -67.06 144.92 71.59 Favored 'Trans proline' 0 C--N 1.307 -1.609 0 C-N-CA 122.511 2.141 . . . . 0.0 112.04 179.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 59.5 p -164.04 28.28 0.08 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.677 179.618 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 132' ' ' ALA . . . . . . . . . . . . . . . -157.18 74.03 4.41 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.771 -179.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 133' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_exo -55.32 137.1 76.35 Favored 'Trans proline' 0 C--N 1.307 -1.651 0 C-N-CA 122.829 2.353 . . . . 0.0 111.659 179.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . 0.534 ' O ' ' N ' ' B' ' 136' ' ' SER . 55.2 mt -88.81 174.55 7.91 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.393 179.773 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 135' ' ' ASP . . . . . 0.503 ' O ' ' N ' ' B' ' 138' ' ' ALA . 94.4 m-20 -42.89 -17.08 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.624 179.68 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . 0.534 ' N ' ' O ' ' B' ' 134' ' ' LEU . 69.3 p -38.35 -38.65 0.38 Allowed 'General case' 0 C--O 1.239 0.512 0 CA-C-O 121.285 0.564 . . . . 0.0 110.423 -179.577 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 137' ' ' GLN . . . . . 0.419 ' CG ' ' N ' ' B' ' 138' ' ' ALA . 23.5 pt20 -65.9 -45.18 82.93 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.398 179.174 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 138' ' ' ALA . . . . . 0.516 ' O ' HG23 ' B' ' 142' ' ' VAL . . . -63.18 -28.16 69.86 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.163 179.708 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.28 -50.82 51.13 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.28 179.703 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -60.33 -46.32 90.3 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.534 179.724 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -54.39 -51.32 65.21 Favored 'General case' 0 C--O 1.241 0.646 0 CA-C-O 121.27 0.557 . . . . 0.0 110.544 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 142' ' ' VAL . . . . . 0.516 HG23 ' O ' ' B' ' 138' ' ' ALA . 90.5 t -62.7 -45.88 97.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.451 179.686 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 143' ' ' ALA . . . . . 0.544 ' HB1' ' N ' ' A' ' 32' ' ' THR . . . -52.05 -44.58 64.32 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 36.7 t -59.43 -44.44 92.9 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.039 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 8.1 m -63.68 -47.06 82.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.485 179.511 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 93.6 mt -66.53 -20.69 66.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.621 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 147' ' ' GLN . . . . . 0.416 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 58.8 tt0 -75.78 -56.85 4.29 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.585 179.287 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -57.93 -54.71 43.83 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.362 -179.424 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.483 ' O ' ' O ' ' B' ' 150' ' ' ALA . 94.2 mt -46.93 -41.7 16.49 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.359 -179.245 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 150' ' ' ALA . . . . . 0.519 ' O ' ' CB ' ' B' ' 151' ' ' THR . . . -50.6 -174.33 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.147 -0.479 . . . . 0.0 109.978 179.651 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 151' ' ' THR . . . . . 0.554 ' N ' ' HB1' ' A' ' 24' ' ' ALA . 1.0 OUTLIER 88.14 117.84 0.03 OUTLIER Pre-proline 0 CA--C 1.538 0.518 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 179.833 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -46.74 -46.47 18.03 Favored 'Trans proline' 0 N--CA 1.495 1.586 0 C-N-CA 122.322 2.015 . . . . 0.0 113.063 -178.518 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 48.1 t -58.97 -44.42 91.53 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.969 -179.253 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 20.7 mmt85 -61.78 -45.91 91.84 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.739 -0.385 . . . . 0.0 111.042 -179.463 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 155' ' ' LEU . . . . . 0.461 ' CD2' ' O ' ' B' ' 149' ' ' LEU . 4.2 mm? -62.76 -47.71 82.35 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 120.598 -0.441 . . . . 0.0 111.073 -179.853 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 156' ' ' MET . . . . . 0.527 ' SD ' HD11 ' B' ' 175' ' ' ILE . 14.4 tmm? -58.29 -49.24 77.84 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 120.337 -0.545 . . . . 0.0 110.612 -179.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 5.9 mm -64.4 -44.91 97.16 Favored 'Isoleucine or valine' 0 C--O 1.239 0.507 0 CA-C-O 121.098 0.475 . . . . 0.0 110.823 -179.504 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 57.7 mt -62.09 -41.77 98.53 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.599 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 28.0 m -59.75 -41.9 92.02 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.179 -0.464 . . . . 0.0 109.815 179.292 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 160' ' ' GLN . . . . . 0.55 ' OE1' ' N ' ' B' ' 160' ' ' GLN . 0.0 OUTLIER -58.02 -49.24 77.55 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.854 -0.425 . . . . 0.0 109.854 179.958 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 161' ' ' LEU . . . . . . . . . . . . . 97.5 mt -63.95 -42.75 97.21 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 120.373 -0.531 . . . . 0.0 110.573 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 162' ' ' ARG . . . . . . . . . . . . . 72.5 ttp85 -71.3 -21.0 62.13 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.51 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 59.4 t-20 -63.18 -41.87 99.27 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.579 -179.53 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . 162.26 -165.44 36.01 Favored Glycine 0 CA--C 1.528 0.853 0 N-CA-C 111.017 -0.833 . . . . 0.0 111.017 -179.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -79.06 112.98 3.15 Favored 'Trans proline' 0 C--N 1.31 -1.486 0 C-N-CA 122.958 2.439 . . . . 0.0 111.769 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 166' ' ' LEU . . . . . 0.436 ' O ' ' O ' ' B' ' 167' ' ' PRO . 0.3 OUTLIER -153.35 85.86 4.11 Favored Pre-proline 0 C--N 1.325 -0.486 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.264 -178.935 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 167' ' ' PRO . . . . . 0.436 ' O ' ' O ' ' B' ' 166' ' ' LEU . 51.4 Cg_exo -50.69 -167.94 0.0 OUTLIER 'Trans proline' 0 C--N 1.306 -1.692 0 C-N-CA 122.607 2.205 . . . . 0.0 112.243 179.76 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . 80.0 t -59.59 -50.41 80.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.973 -179.209 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 169' ' ' THR . . . . . 0.43 ' H ' HG22 ' B' ' 169' ' ' THR . 0.0 OUTLIER -57.54 -44.77 85.44 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.281 0.562 . . . . 0.0 109.976 -179.835 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 -65.51 -34.69 78.85 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.632 179.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 171' ' ' LEU . . . . . 0.603 ' O ' HD13 ' B' ' 171' ' ' LEU . 0.2 OUTLIER -61.62 -44.47 96.92 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 120.466 -0.493 . . . . 0.0 110.02 -179.614 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 172' ' ' ALA . . . . . . . . . . . . . . . -60.39 -44.33 95.78 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 179.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 45.3 tp10 -64.89 -30.65 71.66 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.388 179.736 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -69.92 -54.46 13.3 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.846 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 175' ' ' ILE . . . . . 0.527 HD11 ' SD ' ' B' ' 156' ' ' MET . 93.1 mt -93.56 -68.18 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.293 179.848 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . 133.46 96.75 0.6 Allowed Glycine 0 C--N 1.332 0.333 0 N-CA-C 111.317 -0.713 . . . . 0.0 111.317 -179.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 61.6 mtt 61.91 96.68 0.03 OUTLIER 'General case' 0 CA--C 1.52 -0.19 0 CA-C-O 120.713 0.292 . . . . 0.0 110.765 178.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -178.93 19.02 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.58 179.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 56.0 mt-30 -54.23 -27.24 33.36 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.36 0.6 . . . . 0.0 110.848 -179.059 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 78.5 p -74.41 -32.71 62.77 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.394 179.546 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -73.29 -38.75 65.77 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.584 -178.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 182' ' ' VAL . . . . . 0.583 HG13 ' N ' ' B' ' 183' ' ' SER . 7.3 p -73.42 -49.73 35.04 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.509 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.436 179.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 183' ' ' SER . . . . . 0.583 ' N ' HG13 ' B' ' 182' ' ' VAL . 43.0 t -58.09 -43.77 87.26 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 120.706 -0.397 . . . . 0.0 110.129 -179.533 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 184' ' ' HIS . . . . . 0.495 ' O ' HG23 ' B' ' 188' ' ' VAL . 54.7 t-80 -67.16 -45.01 78.29 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.618 179.687 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -63.65 -49.76 71.97 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.708 -179.411 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -61.31 -44.27 97.48 Favored 'General case' 0 CA--C 1.502 -0.888 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.789 -179.532 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 60.5 ttp180 -59.62 -44.9 93.28 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.143 0.497 . . . . 0.0 110.469 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 188' ' ' VAL . . . . . 0.495 HG23 ' O ' ' B' ' 184' ' ' HIS . 44.2 t -58.93 -52.17 63.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.196 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 86.1 mt -67.82 -28.38 67.52 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.938 0.399 . . . . 0.0 110.361 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 74.9 ttt180 -61.52 -42.34 98.67 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.412 -179.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -60.49 -45.36 94.04 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.71 -0.396 . . . . 0.0 110.437 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 192' ' ' LEU . . . . . . . . . . . . . 10.0 mt -65.03 -40.13 94.38 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.315 179.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 101.0 53.85 1.0 Allowed Glycine 0 N--CA 1.462 0.412 0 N-CA-C 111.005 -0.838 . . . . 0.0 111.005 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 14.9 tp -111.94 -15.06 13.4 Favored 'General case' 0 N--CA 1.462 0.125 0 CA-C-O 120.885 0.374 . . . . 0.0 110.618 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 23.9 m -132.13 163.76 36.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 121.015 0.436 . . . . 0.0 110.349 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 196' ' ' VAL . . . . . 0.598 HG12 ' N ' ' B' ' 197' ' ' GLY . 96.4 t -144.33 163.42 14.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.686 -179.6 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 197' ' ' GLY . . . . . 0.598 ' N ' HG12 ' B' ' 196' ' ' VAL . . . -109.21 160.04 13.74 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.534 -1.026 . . . . 0.0 110.534 179.598 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -140.82 110.92 6.6 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.738 0.304 . . . . 0.0 110.734 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 73.3 ttp85 -73.62 128.28 35.08 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.462 179.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 200' ' ' ALA . . . . . 0.435 ' O ' ' O ' ' B' ' 203' ' ' SER . . . -171.65 139.71 1.25 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.513 179.769 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 201' ' ' GLY . . . . . . . . . . . . . . . 55.37 48.78 67.51 Favored Glycine 0 CA--C 1.525 0.7 0 N-CA-C 110.878 -0.889 . . . . 0.0 110.878 179.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 202' ' ' ARG . . . . . . . . . . . . . 84.4 mtp180 49.04 26.96 1.53 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.631 0.253 . . . . 0.0 110.563 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 203' ' ' SER . . . . . 0.435 ' O ' ' O ' ' B' ' 200' ' ' ALA . 33.1 t -150.26 139.75 21.49 Favored 'General case' 0 CA--C 1.52 -0.187 0 CA-C-O 121.116 0.484 . . . . 0.0 110.179 179.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 204' ' ' ILE . . . . . 0.703 HD11 ' CE2' ' B' ' 206' ' ' TYR . 1.3 pp -93.14 146.73 6.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.287 179.773 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 69.8 t -120.89 134.87 62.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.085 179.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 206' ' ' TYR . . . . . 0.703 ' CE2' HD11 ' B' ' 204' ' ' ILE . 59.0 m-85 -91.8 125.12 36.39 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.512 179.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 67.8 m -139.26 158.53 43.99 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.502 -179.549 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . 15.9 mt -66.91 138.91 57.64 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.457 -179.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 15.2 t80 -54.77 -51.99 64.0 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.674 -179.772 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 63.8 m-20 -99.85 135.36 41.39 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.827 0.346 . . . . 0.0 110.673 -179.396 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 76.2 p -75.74 -24.26 56.09 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.374 179.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 212' ' ' HIS . . . . . . . . . . . . . 74.3 m80 -57.32 -43.48 83.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.289 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 74.5 t -57.67 -43.58 83.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 214' ' ' ALA . . . . . . . . . . . . . . . -59.7 -45.61 91.59 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.366 179.478 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 69.5 tp60 -63.63 -41.94 98.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.265 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 216' ' ' LEU . . . . . . . . . . . . . 14.6 tp -59.05 -43.93 91.73 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.025 -179.283 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 82.1 mt -64.51 -39.41 93.73 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.099 179.526 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -58.82 -42.3 88.89 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.514 -179.778 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 219' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -67.14 -51.43 54.04 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.534 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -59.77 -41.48 91.18 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.062 0.458 . . . . 0.0 110.406 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 4.4 mm -61.78 -44.04 98.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.674 -179.714 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 222' ' ' TYR . . . . . 0.432 ' O ' ' ND1' ' B' ' 226' ' ' HIS . 4.2 m-85 -66.36 -38.53 87.79 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.271 179.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 223' ' ' HIS . . . . . . . . . . . . . 3.3 t60 -58.48 -43.08 88.86 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.526 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 37.5 t -77.89 -36.27 49.81 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.9 179.494 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 225' ' ' GLU . . . . . 0.504 ' C ' ' H ' ' B' ' 227' ' ' LEU . 37.0 tp10 -59.86 -30.94 69.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.529 -179.276 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 226' ' ' HIS . . . . . 0.555 ' O ' ' CB ' ' B' ' 227' ' ' LEU . 27.3 m80 -62.55 4.21 0.17 Allowed 'General case' 0 CA--C 1.507 -0.704 0 CA-C-O 118.681 -0.676 . . . . 0.0 111.264 -179.707 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 227' ' ' LEU . . . . . 0.579 ' C ' HD23 ' B' ' 227' ' ' LEU . 3.6 tt 96.29 110.67 0.02 OUTLIER 'General case' 0 C--N 1.344 0.361 0 O-C-N 124.589 1.181 . . . . 0.0 110.84 179.834 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 228' ' ' HIS . . . . . 0.536 ' N ' HD23 ' B' ' 227' ' ' LEU . 48.0 t-80 -152.12 104.04 2.93 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.497 179.26 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 229' ' ' LEU . . . . . . . . . . . . . 82.5 mt -62.4 -42.97 99.84 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.31 -179.124 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . 42.06 74.11 0.19 Allowed Glycine 0 CA--C 1.524 0.652 0 N-CA-C 110.935 -0.866 . . . . 0.0 110.935 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 231' ' ' LEU . . . . . . . . . . . . . 52.6 tp -76.01 129.81 37.44 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.615 -179.672 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 232' ' ' SER . . . . . . . . . . . . . 10.4 p -77.03 151.11 35.7 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.536 179.342 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 233' ' ' ASP . . . . . . . . . . . . . 91.4 m-20 -100.56 1.25 40.72 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.573 179.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 234' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -64.81 -101.91 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.663 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 235' ' ' HIS . . . . . . . . . . . . . 11.4 m-70 43.52 71.54 1.43 Allowed Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.571 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 236' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -59.76 143.09 99.69 Favored 'Trans proline' 0 C--N 1.306 -1.696 0 C-N-CA 122.692 2.261 . . . . 0.0 111.736 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 237' ' ' SER . . . . . . . . . . . . . 66.7 m -115.32 121.5 43.04 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.468 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 238' ' ' ALA . . . . . . . . . . . . . . . -70.31 143.44 52.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.544 179.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.761 0 CA-C-O 118.098 -1.39 . . . . 0.0 110.882 -179.992 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.262 0 N-CA-C 109.512 -1.435 . . . . 0.0 109.512 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -84.65 127.57 34.15 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.811 0.338 . . . . 0.0 110.504 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -88.54 93.43 1.89 Allowed Glycine 0 CA--C 1.526 0.725 0 N-CA-C 110.939 -0.865 . . . . 0.0 110.939 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 19.1 m -73.22 -24.66 20.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 120.898 0.38 . . . . 0.0 110.665 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 17.2 pt-20 -67.41 149.14 50.65 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.648 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -151.87 -101.14 0.21 Allowed Glycine 0 CA--C 1.523 0.581 0 N-CA-C 110.877 -0.889 . . . . 0.0 110.877 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 41.5 ttm180 44.89 90.45 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.695 0.284 . . . . 0.0 110.491 -179.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.5 ' CG ' ' H ' ' A' ' 10' ' ' ARG . 59.3 t30 -141.67 -144.59 0.16 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.417 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.5 ' H ' ' CG ' ' A' ' 9' ' ' ASN . 64.1 mtm180 55.87 57.93 9.85 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.604 -179.75 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -71.63 146.99 50.37 Favored 'Trans proline' 0 C--N 1.31 -1.493 0 C-N-CA 122.677 2.251 . . . . 0.0 112.1 -179.901 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.425 ' O ' ' HB2' ' A' ' 13' ' ' ALA . 44.9 t -161.36 124.28 3.15 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.186 179.579 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.562 ' HB3' ' HD3' ' A' ' 14' ' ' PRO . . . 175.37 -45.96 0.0 OUTLIER Pre-proline 0 CA--C 1.533 0.326 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.482 -179.541 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.562 ' HD3' ' HB3' ' A' ' 13' ' ' ALA . 52.2 Cg_exo -52.79 -162.13 0.0 OUTLIER 'Trans proline' 0 C--N 1.313 -1.333 0 C-N-CA 122.498 2.132 . . . . 0.0 112.18 -178.712 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.527 ' O ' ' N ' ' A' ' 17' ' ' SER . 70.2 mt -66.39 153.94 41.43 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.153 -179.869 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.525 ' O ' ' N ' ' A' ' 19' ' ' ALA . 99.2 m-20 -43.33 -16.96 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.63 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.527 ' N ' ' O ' ' A' ' 15' ' ' LEU . 86.4 p -38.46 -40.16 0.53 Allowed 'General case' 0 C--O 1.236 0.368 0 CA-C-O 121.239 0.542 . . . . 0.0 110.473 -179.788 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 94.8 mm-40 -65.49 -42.93 91.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.191 179.235 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.525 ' N ' ' O ' ' A' ' 16' ' ' ASP . . . -65.79 -28.77 69.26 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.501 179.407 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.61 -52.84 27.13 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.376 179.718 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.8 -49.58 76.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.914 0.387 . . . . 0.0 111.153 179.563 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 66.5 tp60 -53.62 -50.11 66.39 Favored 'General case' 0 C--O 1.242 0.682 0 CA-C-O 121.722 0.772 . . . . 0.0 109.996 -179.559 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.424 HG23 ' O ' ' A' ' 19' ' ' ALA . 57.7 t -62.59 -41.76 93.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.639 -0.709 . . . . 0.0 109.689 179.517 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.462 ' HB2' HD12 ' B' ' 155' ' ' LEU . . . -50.68 -47.43 58.81 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.176 179.785 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 40.3 t -60.22 -43.84 95.67 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.318 -0.401 . . . . 0.0 109.982 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 24.2 m -63.24 -51.77 64.87 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.253 -0.579 . . . . 0.0 110.934 179.72 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 88.6 mt -67.76 -21.1 65.28 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.761 -179.603 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.428 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 52.7 tt0 -75.05 -60.56 2.24 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.759 179.467 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.494 ' HB1' ' NH1' ' A' ' 35' ' ' ARG . . . -58.33 -53.04 62.74 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.863 -179.063 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.432 ' O ' ' C ' ' A' ' 31' ' ' ALA . 4.0 mm? -51.23 -41.37 60.27 Favored 'General case' 0 CA--C 1.509 -0.634 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 -178.475 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.563 ' O ' ' C ' ' A' ' 32' ' ' THR . . . -39.22 -70.81 0.09 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.431 179.757 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.563 ' C ' ' O ' ' A' ' 31' ' ' ALA . 7.1 p -3.35 107.16 0.03 OUTLIER Pre-proline 0 N--CA 1.48 1.027 0 O-C-N 124.583 1.177 . . . . 0.0 111.018 -179.685 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -47.3 -48.47 15.0 Favored 'Trans proline' 0 C--N 1.307 -1.611 0 C-N-CA 122.073 1.849 . . . . 0.0 113.31 -177.635 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 11.1 t -57.62 -44.14 85.28 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.659 -179.297 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.494 ' NH1' ' HB1' ' A' ' 29' ' ' ALA . 38.5 ttm180 -61.18 -45.24 95.43 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 120.643 -0.423 . . . . 0.0 110.71 -179.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.548 ' O ' HG23 ' A' ' 40' ' ' THR . 80.3 mt -57.69 -52.28 66.09 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.313 -0.555 . . . . 0.0 110.707 -179.761 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.43 ' O ' ' OG1' ' A' ' 40' ' ' THR . 53.9 ttp -53.63 -46.23 70.42 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.221 -0.592 . . . . 0.0 110.583 179.412 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.603 HD12 HE22 ' A' ' 66' ' ' GLN . 97.5 mt -62.36 -48.03 90.26 Favored 'Isoleucine or valine' 0 C--O 1.239 0.529 0 CA-C-O 121.332 0.587 . . . . 0.0 110.798 -179.572 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -61.89 -41.56 98.03 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.575 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.548 HG23 ' O ' ' A' ' 36' ' ' LEU . 37.4 p -61.77 -33.98 75.06 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.988 179.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 60.8 tp60 -64.47 -50.49 67.27 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 120.603 -0.439 . . . . 0.0 109.897 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 16.6 mt -62.86 -30.45 71.52 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.495 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 10.8 ttm180 -42.58 -41.29 2.99 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.586 -179.512 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 95.1 m-20 -62.36 -42.92 99.78 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.981 0.42 . . . . 0.0 110.186 -179.747 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 162.23 178.32 36.01 Favored Glycine 0 CA--C 1.527 0.8 0 C-N-CA 120.559 -0.829 . . . . 0.0 111.361 179.027 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 15.1 Cg_exo -67.33 148.07 79.21 Favored 'Trans proline' 0 N--CA 1.49 1.28 0 C-N-CA 122.85 2.367 . . . . 0.0 111.899 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.569 HD12 ' O ' ' A' ' 47' ' ' LEU . 0.3 OUTLIER -164.43 159.4 15.86 Favored Pre-proline 0 CA--C 1.536 0.414 0 C-N-CA 120.262 -0.575 . . . . 0.0 110.793 178.734 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_exo -66.79 149.33 83.48 Favored 'Trans proline' 0 N--CA 1.496 1.629 0 C-N-CA 122.589 2.193 . . . . 0.0 112.292 178.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.46 HG23 ' N ' ' A' ' 50' ' ' THR . 5.0 m -64.57 -39.73 86.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.815 0.817 . . . . 0.0 110.695 179.193 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.46 ' N ' HG23 ' A' ' 49' ' ' VAL . 8.5 m -56.34 -66.08 0.5 Allowed 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 114.738 -1.119 . . . . 0.0 110.548 179.316 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -50.43 -39.24 46.97 Favored 'General case' 0 C--O 1.24 0.559 0 CA-C-O 121.441 0.639 . . . . 0.0 109.645 -179.204 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.57 HD23 ' O ' ' A' ' 52' ' ' LEU . 1.4 tt -59.55 -42.17 91.77 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.859 -0.61 . . . . 0.0 109.433 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.533 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -65.0 -42.87 94.11 Favored 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 120.863 -0.335 . . . . 0.0 110.135 179.591 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 83.6 tt0 -53.62 -34.23 57.79 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 179.901 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -72.13 -38.87 69.17 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.582 178.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 96.8 mt -88.41 -68.95 0.62 Allowed 'Isoleucine or valine' 0 CA--C 1.521 -0.173 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.244 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . 0.533 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 148.94 71.25 0.01 OUTLIER Glycine 0 CA--C 1.521 0.451 0 N-CA-C 111.682 -0.567 . . . . 0.0 111.682 179.617 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 4.1 mmt 57.83 79.15 0.21 Allowed 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 120.779 0.323 . . . . 0.0 110.641 179.35 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 86.4 mt-10 -150.91 19.93 0.78 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.729 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -61.77 -30.64 70.93 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.411 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 36.0 t -65.26 -42.94 92.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.524 -179.8 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.53 -30.88 71.62 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.082 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 89.8 t -70.49 -49.91 49.39 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.209 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.566 179.436 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 38.8 t -57.06 -42.56 80.79 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 120.892 0.377 . . . . 0.0 110.249 -179.787 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 43.5 t60 -60.91 -50.6 72.76 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-O 121.259 0.552 . . . . 0.0 110.499 179.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.603 HE22 HD12 ' A' ' 38' ' ' ILE . 37.0 mt-30 -62.32 -34.54 76.82 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.069 179.646 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.483 HD21 HH21 ' A' ' 71' ' ' ARG . 2.4 tp -62.91 -43.68 98.14 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.223 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 95.5 mtt-85 -62.57 -41.56 99.0 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 120.849 0.356 . . . . 0.0 110.186 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 86.2 t -63.1 -53.84 41.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.199 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 12.5 mt -61.13 -40.85 95.35 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.027 0.441 . . . . 0.0 110.048 -179.485 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.483 HH21 HD21 ' A' ' 67' ' ' LEU . 62.2 ttm-85 -54.83 -41.01 70.16 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.941 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 -60.14 -48.18 82.81 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 120.396 -0.522 . . . . 0.0 110.495 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.4 mt -66.87 -41.47 87.21 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.936 0.398 . . . . 0.0 110.555 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 100.41 88.99 2.02 Favored Glycine 0 CA--C 1.52 0.389 0 N-CA-C 110.947 -0.861 . . . . 0.0 110.947 -179.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 5.1 tp -152.2 -14.17 0.18 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.749 0.309 . . . . 0.0 110.853 179.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.434 ' HA ' ' H ' ' A' ' 90' ' ' TYR . 28.1 m -134.96 158.64 41.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.066 -179.701 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.681 HG12 ' N ' ' A' ' 78' ' ' GLY . 59.4 t -124.07 170.98 13.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.276 -179.635 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.681 ' N ' HG12 ' A' ' 77' ' ' VAL . . . -158.53 149.13 19.17 Favored Glycine 0 CA--C 1.526 0.733 0 N-CA-C 110.604 -0.998 . . . . 0.0 110.604 179.386 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 62.7 t0 -124.7 123.46 40.07 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 120.905 0.383 . . . . 0.0 110.447 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 94.9 mtt-85 -73.79 153.47 39.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.54 -179.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -165.38 97.43 0.69 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.636 -179.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 64.11 -124.15 29.55 Favored Glycine 0 CA--C 1.524 0.624 0 N-CA-C 110.831 -0.908 . . . . 0.0 110.831 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 34.9 ptt180 -96.79 13.13 29.61 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.47 0.176 . . . . 0.0 110.797 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 24.7 m -141.68 163.8 31.93 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-O 121.084 0.468 . . . . 0.0 109.903 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.977 HD11 ' CE2' ' A' ' 87' ' ' TYR . 0.8 OUTLIER -141.94 162.81 19.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.225 179.907 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.763 ' N ' HD12 ' A' ' 85' ' ' ILE . 52.2 t -113.19 138.42 42.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.977 ' CE2' HD11 ' A' ' 85' ' ' ILE . 0.2 OUTLIER -112.25 136.06 52.15 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.063 -179.815 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 1.9 m -150.92 171.66 16.9 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.805 -0.442 . . . . 0.0 109.805 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 34.0 mt -84.28 143.31 29.63 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.616 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.434 ' H ' ' HA ' ' A' ' 76' ' ' VAL . 77.5 t80 -60.42 -45.67 92.79 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.689 179.665 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 35.7 p30 -141.98 171.5 13.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.507 -179.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . 0.486 ' O ' ' HB3' ' A' ' 95' ' ' ALA . 54.9 p -96.83 -7.23 34.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.564 -179.854 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . 0.606 ' CG ' ' CE1' ' B' ' 223' ' ' HIS . 61.4 m80 -41.85 -61.45 1.11 Allowed 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.033 0.444 . . . . 0.0 110.637 179.734 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 69.1 t -53.88 -41.04 47.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.788 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.486 ' HB3' ' O ' ' A' ' 92' ' ' THR . . . -56.84 -43.51 81.17 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.346 179.79 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 90.6 mt-30 -62.27 -45.4 93.46 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 121.153 0.502 . . . . 0.0 110.132 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 13.6 tp -56.84 -44.38 82.04 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.007 -179.332 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 92.9 mt -64.13 -37.12 86.3 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.01 179.546 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 46.3 t0 -56.47 -45.62 80.8 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.107 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.463 ' OE2' ' OE2' ' B' ' 219' ' ' GLU . 91.7 mt-10 -67.52 -52.09 43.16 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.604 179.382 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -52.74 -46.39 67.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.057 179.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 5.2 mm -63.39 -44.25 98.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 121.132 0.491 . . . . 0.0 110.71 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -60.65 -46.19 91.26 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.254 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . 0.61 ' CE1' ' CG ' ' B' ' 212' ' ' HIS . 68.2 t60 -65.29 -36.81 85.21 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.465 179.733 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 47.2 t -59.48 -46.59 88.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.333 -179.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 77.9 tt0 -74.7 -60.55 2.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.075 0.464 . . . . 0.0 110.807 179.333 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 85.6 t60 -50.14 -28.62 7.65 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.913 -179.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.435 ' C ' HD13 ' A' ' 108' ' ' LEU . 0.2 OUTLIER -110.83 89.11 2.95 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.489 179.748 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 49.7 t-80 -152.55 14.42 0.57 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.708 179.522 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 88.4 mt -62.67 -43.0 99.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.606 -179.741 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 70.87 -177.01 35.49 Favored Glycine 0 CA--C 1.523 0.567 0 N-CA-C 110.692 -0.963 . . . . 0.0 110.692 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -144.12 73.27 1.38 Allowed 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 110.218 -0.29 . . . . 0.0 110.218 179.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.477 ' O ' ' O ' ' A' ' 114' ' ' ASP . 83.1 p 39.89 -153.18 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.514 179.771 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . 0.477 ' O ' ' O ' ' A' ' 113' ' ' SER . 98.5 m-20 57.38 137.2 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.057 0.456 . . . . 0.0 110.725 179.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 6.7 ptp180 -141.23 150.33 42.52 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.57 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . 0.449 ' CG ' ' O ' ' A' ' 116' ' ' HIS . 5.3 p80 -167.37 72.9 1.0 Allowed Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.407 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -52.58 -38.85 76.2 Favored 'Trans proline' 0 C--N 1.307 -1.653 0 C-N-CA 122.828 2.352 . . . . 0.0 112.106 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 64.8 m -130.71 152.47 50.03 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.544 -179.629 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -63.75 -37.96 89.32 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.497 -179.795 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.693 0 CA-C-O 118.068 -1.407 . . . . 0.0 110.938 -179.962 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.321 0 N-CA-C 109.526 -1.429 . . . . 0.0 109.526 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 98.8 m-70 -97.76 126.15 42.96 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.8 0.333 . . . . 0.0 110.451 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 123' ' ' GLY . . . . . . . . . . . . . . . -86.27 94.29 1.93 Allowed Glycine 0 CA--C 1.524 0.629 0 N-CA-C 110.979 -0.849 . . . . 0.0 110.979 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 16.6 m -75.59 -21.89 16.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.004 0.43 . . . . 0.0 110.683 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 125' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -69.54 150.2 47.39 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.614 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -152.16 -103.91 0.25 Allowed Glycine 0 CA--C 1.524 0.616 0 N-CA-C 110.873 -0.891 . . . . 0.0 110.873 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 127' ' ' ARG . . . . . . . . . . . . . 41.8 ttm180 47.29 87.55 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.648 0.261 . . . . 0.0 110.45 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 128' ' ' ASN . . . . . 0.518 ' CG ' ' H ' ' B' ' 129' ' ' ARG . 60.1 t30 -139.0 -146.07 0.2 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.32 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 129' ' ' ARG . . . . . 0.518 ' H ' ' CG ' ' B' ' 128' ' ' ASN . 69.0 mtm180 56.56 59.42 8.37 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.532 -179.76 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -72.49 148.86 48.89 Favored 'Trans proline' 0 C--N 1.311 -1.44 0 C-N-CA 122.757 2.305 . . . . 0.0 112.136 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 131' ' ' SER . . . . . 0.468 ' O ' ' HB2' ' B' ' 132' ' ' ALA . 42.6 t -163.09 126.12 2.73 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.233 179.632 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 132' ' ' ALA . . . . . 0.57 ' N ' ' CD ' ' B' ' 133' ' ' PRO . . . 172.86 -44.71 0.0 OUTLIER Pre-proline 0 CA--C 1.534 0.34 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.436 -179.477 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 133' ' ' PRO . . . . . 0.57 ' CD ' ' N ' ' B' ' 132' ' ' ALA . 51.5 Cg_exo -54.08 -162.98 0.01 OUTLIER 'Trans proline' 0 C--N 1.313 -1.296 0 C-N-CA 122.549 2.166 . . . . 0.0 112.04 -178.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . 0.53 ' O ' ' N ' ' B' ' 136' ' ' SER . 63.5 mt -66.01 153.56 41.85 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.218 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 135' ' ' ASP . . . . . 0.52 ' O ' ' N ' ' B' ' 138' ' ' ALA . 97.9 m-20 -43.08 -17.11 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.631 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . 0.53 ' N ' ' O ' ' B' ' 134' ' ' LEU . 92.8 p -38.43 -40.08 0.52 Allowed 'General case' 0 C--O 1.236 0.352 0 CA-C-O 121.27 0.557 . . . . 0.0 110.403 -179.71 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 95.9 mm-40 -65.66 -43.27 89.91 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.172 179.175 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 138' ' ' ALA . . . . . 0.52 ' N ' ' O ' ' B' ' 135' ' ' ASP . . . -64.81 -29.1 70.05 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.489 179.44 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.83 -52.43 30.02 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.338 179.734 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -60.47 -50.14 74.76 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.929 0.395 . . . . 0.0 111.172 179.592 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 68.1 tp60 -53.92 -49.55 68.4 Favored 'General case' 0 C--O 1.243 0.72 0 CA-C-O 121.591 0.71 . . . . 0.0 110.019 -179.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 142' ' ' VAL . . . . . 0.432 HG23 ' O ' ' B' ' 138' ' ' ALA . 53.4 t -62.21 -42.71 96.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.784 179.38 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 143' ' ' ALA . . . . . 0.438 ' HB2' HD12 ' A' ' 36' ' ' LEU . . . -50.24 -46.76 55.07 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.011 179.648 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 11.3 t -59.99 -44.51 94.48 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.155 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 19.8 m -63.75 -51.36 65.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.265 0.555 . . . . 0.0 111.049 179.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 92.5 mt -67.75 -21.1 65.29 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.909 -179.572 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 147' ' ' GLN . . . . . 0.41 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 53.2 tt0 -75.34 -59.37 2.77 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.728 179.417 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 148' ' ' ALA . . . . . 0.486 ' HB1' ' NH1' ' B' ' 154' ' ' ARG . . . -59.02 -53.69 55.56 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.049 -179.159 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.441 ' O ' ' C ' ' B' ' 150' ' ' ALA . 4.0 mm? -50.86 -41.95 58.37 Favored 'General case' 0 CA--C 1.509 -0.599 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 -178.304 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 150' ' ' ALA . . . . . 0.553 ' O ' ' C ' ' B' ' 151' ' ' THR . . . -38.91 -72.18 0.07 Allowed 'General case' 0 CA--C 1.511 -0.555 0 O-C-N 123.519 0.512 . . . . 0.0 110.334 179.719 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 151' ' ' THR . . . . . 0.553 ' C ' ' O ' ' B' ' 150' ' ' ALA . 6.5 p -1.77 105.74 0.02 OUTLIER Pre-proline 0 N--CA 1.478 0.948 0 O-C-N 124.428 1.08 . . . . 0.0 111.088 -179.839 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo -46.32 -48.73 12.77 Favored 'Trans proline' 0 C--N 1.307 -1.648 0 C-N-CA 122.053 1.836 . . . . 0.0 113.154 -177.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 11.3 t -57.2 -43.99 83.22 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.722 -179.214 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 154' ' ' ARG . . . . . 0.486 ' NH1' ' HB1' ' B' ' 148' ' ' ALA . 38.7 ttm180 -62.42 -43.86 97.82 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.592 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 155' ' ' LEU . . . . . 0.518 ' O ' HG23 ' B' ' 159' ' ' THR . 31.5 mt -58.4 -51.5 69.57 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.424 -0.511 . . . . 0.0 110.718 -179.561 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 156' ' ' MET . . . . . 0.401 ' O ' ' OG1' ' B' ' 159' ' ' THR . 51.9 ttp -55.44 -45.65 76.81 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 120.267 -0.573 . . . . 0.0 110.596 179.727 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 97.0 mt -62.65 -47.4 93.08 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 CA-C-O 121.378 0.609 . . . . 0.0 110.87 -179.514 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -62.53 -41.31 98.79 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.602 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 159' ' ' THR . . . . . 0.518 HG23 ' O ' ' B' ' 155' ' ' LEU . 31.3 p -62.47 -32.77 73.71 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.064 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 59.2 tp60 -64.93 -50.17 67.51 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.223 -0.444 . . . . 0.0 109.949 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 161' ' ' LEU . . . . . 0.429 ' O ' ' N ' ' B' ' 164' ' ' GLY . 17.0 mt -62.49 -31.75 72.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.584 179.776 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 162' ' ' ARG . . . . . . . . . . . . . 11.2 ttm180 -40.82 -41.47 1.58 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.618 -179.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -62.33 -42.25 99.23 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.316 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 164' ' ' GLY . . . . . 0.429 ' N ' ' O ' ' B' ' 161' ' ' LEU . . . 161.03 178.58 35.13 Favored Glycine 0 CA--C 1.527 0.785 0 C-N-CA 120.672 -0.775 . . . . 0.0 111.331 179.086 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_exo -67.74 147.94 76.44 Favored 'Trans proline' 0 N--CA 1.49 1.272 0 C-N-CA 122.836 2.357 . . . . 0.0 112.028 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 166' ' ' LEU . . . . . 0.577 ' O ' HD12 ' B' ' 166' ' ' LEU . 0.3 OUTLIER -163.76 160.61 17.36 Favored Pre-proline 0 CA--C 1.534 0.359 0 C-N-CA 120.133 -0.627 . . . . 0.0 110.701 178.717 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 16.1 Cg_exo -68.22 149.33 75.98 Favored 'Trans proline' 0 N--CA 1.495 1.583 0 C-N-CA 122.525 2.15 . . . . 0.0 112.119 178.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 168' ' ' VAL . . . . . 0.456 HG23 ' N ' ' B' ' 169' ' ' THR . 4.5 m -64.54 -40.0 87.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 121.819 0.818 . . . . 0.0 110.728 179.143 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 169' ' ' THR . . . . . 0.456 ' N ' HG23 ' B' ' 168' ' ' VAL . 7.0 m -55.87 -66.5 0.41 Allowed 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 114.702 -1.135 . . . . 0.0 110.496 179.381 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 93.2 m-20 -50.35 -39.91 47.65 Favored 'General case' 0 C--O 1.239 0.546 0 CA-C-O 121.326 0.584 . . . . 0.0 109.687 -179.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 171' ' ' LEU . . . . . 0.596 HD23 ' O ' ' B' ' 171' ' ' LEU . 1.5 tt -58.99 -42.5 90.18 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.379 -0.601 . . . . 0.0 109.379 -179.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 172' ' ' ALA . . . . . 0.539 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -64.37 -42.63 96.08 Favored 'General case' 0 N--CA 1.446 -0.675 0 C-N-CA 120.826 -0.35 . . . . 0.0 110.18 179.575 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -53.92 -34.51 59.78 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.099 -0.5 . . . . 0.0 109.695 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -71.97 -38.22 69.77 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.574 178.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 96.7 mt -88.55 -69.43 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.519 -0.246 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.296 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 176' ' ' GLY . . . . . 0.539 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 148.98 70.43 0.01 OUTLIER Glycine 0 CA--C 1.522 0.5 0 N-CA-C 111.518 -0.633 . . . . 0.0 111.518 179.654 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 3.9 mmt 58.71 78.46 0.25 Allowed 'General case' 0 N--CA 1.462 0.148 0 CA-C-O 120.782 0.325 . . . . 0.0 110.807 179.282 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 86.3 mt-10 -150.55 20.15 0.82 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.8 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -61.69 -29.96 70.43 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.056 0.455 . . . . 0.0 110.29 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 6.9 t -65.57 -43.38 89.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.529 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -62.31 -30.81 71.41 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.177 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 83.9 t -71.0 -50.36 43.17 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.185 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.591 179.497 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 42.9 t -57.37 -41.74 80.74 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.928 0.394 . . . . 0.0 110.336 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 19.5 t60 -61.64 -51.0 70.27 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.212 0.53 . . . . 0.0 110.51 179.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 36.4 mt-30 -62.65 -32.81 73.92 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.015 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 186' ' ' LEU . . . . . 0.436 HD21 HH21 ' B' ' 190' ' ' ARG . 2.7 tp -63.27 -44.12 96.02 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.1 179.876 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -62.63 -41.88 99.28 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 120.729 -0.388 . . . . 0.0 110.31 -179.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 98.1 t -62.58 -54.13 38.0 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 C-N-CA 119.974 -0.69 . . . . 0.0 110.351 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 12.6 mt -60.73 -40.35 92.01 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.08 0.466 . . . . 0.0 110.049 -179.479 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 190' ' ' ARG . . . . . 0.436 HH21 HD21 ' B' ' 186' ' ' LEU . 62.7 ttm-85 -55.15 -41.68 72.12 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.025 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 92.1 m-20 -59.69 -46.82 87.92 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.439 -0.504 . . . . 0.0 110.281 -179.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 192' ' ' LEU . . . . . . . . . . . . . 9.7 mt -67.11 -39.75 86.74 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.953 0.406 . . . . 0.0 110.417 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 97.54 88.79 1.88 Allowed Glycine 0 N--CA 1.463 0.474 0 N-CA-C 110.765 -0.934 . . . . 0.0 110.765 -179.651 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 4.7 tp -152.45 -13.64 0.17 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.802 0.334 . . . . 0.0 110.859 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 195' ' ' VAL . . . . . 0.429 ' HA ' ' H ' ' B' ' 209' ' ' TYR . 27.7 m -135.02 158.64 41.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 109.832 -0.432 . . . . 0.0 109.832 -179.697 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 196' ' ' VAL . . . . . 0.665 HG12 ' N ' ' B' ' 197' ' ' GLY . 64.7 t -121.8 169.02 13.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.323 -179.688 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 197' ' ' GLY . . . . . 0.665 ' N ' HG12 ' B' ' 196' ' ' VAL . . . -157.33 142.04 8.31 Favored Glycine 0 CA--C 1.525 0.665 0 N-CA-C 110.615 -0.994 . . . . 0.0 110.615 179.471 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 60.4 t0 -119.63 125.26 48.3 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 120.935 0.398 . . . . 0.0 110.559 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 94.1 mtt-85 -75.03 152.56 38.68 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.572 -179.871 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 200' ' ' ALA . . . . . . . . . . . . . . . -164.69 99.32 0.79 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.523 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 201' ' ' GLY . . . . . . . . . . . . . . . 60.82 -125.31 37.95 Favored Glycine 0 CA--C 1.522 0.506 0 N-CA-C 110.752 -0.939 . . . . 0.0 110.752 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 202' ' ' ARG . . . . . . . . . . . . . 35.1 ptt180 -96.68 21.05 9.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.546 0.212 . . . . 0.0 110.667 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 30.9 m -150.18 162.98 39.39 Favored 'General case' 0 CA--C 1.517 -0.299 0 N-CA-C 109.722 -0.474 . . . . 0.0 109.722 -179.667 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 204' ' ' ILE . . . . . 0.963 HD11 ' CE2' ' B' ' 206' ' ' TYR . 0.8 OUTLIER -141.72 162.24 20.64 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.187 -179.967 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 205' ' ' VAL . . . . . 0.744 ' N ' HD12 ' B' ' 204' ' ' ILE . 55.6 t -112.79 134.79 54.26 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 179.546 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 206' ' ' TYR . . . . . 0.963 ' CE2' HD11 ' B' ' 204' ' ' ILE . 0.2 OUTLIER -108.43 135.9 48.94 Favored 'General case' 0 N--CA 1.469 0.485 0 O-C-N 123.58 0.55 . . . . 0.0 109.987 -179.834 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 3.1 m -150.63 171.16 17.57 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 -179.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . 29.5 mt -83.77 143.13 30.19 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.623 -179.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 209' ' ' TYR . . . . . 0.442 ' HA ' HG23 ' B' ' 196' ' ' VAL . 81.0 t80 -60.69 -46.02 91.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.71 179.77 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 43.2 p30 -140.84 172.56 12.52 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.338 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 211' ' ' THR . . . . . 0.472 ' O ' ' HB3' ' B' ' 214' ' ' ALA . 43.5 p -98.37 -7.65 28.42 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.439 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 212' ' ' HIS . . . . . 0.61 ' CG ' ' CE1' ' A' ' 104' ' ' HIS . 60.5 m80 -41.7 -61.33 1.11 Allowed 'General case' 0 C--O 1.233 0.224 0 CA-C-O 120.96 0.41 . . . . 0.0 110.419 179.779 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 92.0 t -53.88 -41.64 49.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.181 -0.463 . . . . 0.0 109.771 -179.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 214' ' ' ALA . . . . . 0.472 ' HB3' ' O ' ' B' ' 211' ' ' THR . . . -56.44 -43.37 79.43 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.368 179.814 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 84.3 mt-30 -62.38 -45.26 93.97 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.072 -179.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 216' ' ' LEU . . . . . . . . . . . . . 12.6 tp -56.61 -44.38 81.1 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.509 -0.477 . . . . 0.0 109.898 -179.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 92.5 mt -63.8 -38.23 90.32 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.093 179.522 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 58.0 t0 -56.05 -45.84 79.09 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.08 -179.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 219' ' ' GLU . . . . . 0.463 ' OE2' ' OE2' ' A' ' 100' ' ' GLU . 93.6 mt-10 -67.66 -51.79 45.67 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.708 -0.397 . . . . 0.0 110.62 179.462 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -53.09 -46.32 68.59 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 179.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 4.8 mm -63.73 -44.08 98.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 121.084 0.469 . . . . 0.0 110.613 -179.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 84.5 t80 -60.58 -45.76 92.76 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.017 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 223' ' ' HIS . . . . . 0.606 ' CE1' ' CG ' ' A' ' 93' ' ' HIS . 68.5 t60 -65.55 -37.01 85.47 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.534 179.641 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 11.5 t -59.12 -46.73 87.58 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.339 -179.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -74.58 -59.8 2.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.09 0.472 . . . . 0.0 110.663 179.348 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 86.1 t60 -50.51 -30.31 12.62 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.877 -179.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 227' ' ' LEU . . . . . 0.426 ' CB ' ' O ' ' B' ' 223' ' ' HIS . 0.2 OUTLIER -108.94 87.77 2.57 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.564 179.76 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 228' ' ' HIS . . . . . 0.495 ' ND1' ' O ' ' B' ' 228' ' ' HIS . 56.3 t-80 -151.66 15.66 0.68 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.687 179.538 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 229' ' ' LEU . . . . . . . . . . . . . 84.9 mt -63.47 -43.39 97.46 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.836 -179.741 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . 71.44 -177.23 37.09 Favored Glycine 0 CA--C 1.525 0.696 0 N-CA-C 110.664 -0.975 . . . . 0.0 110.664 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 231' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -144.8 72.34 1.33 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.713 0.292 . . . . 0.0 110.311 -179.882 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 232' ' ' SER . . . . . 0.482 ' O ' ' O ' ' B' ' 233' ' ' ASP . 85.8 p 40.63 -153.19 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.597 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 233' ' ' ASP . . . . . 0.482 ' O ' ' O ' ' B' ' 232' ' ' SER . 97.8 m-20 57.26 138.37 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.182 0.515 . . . . 0.0 110.708 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 234' ' ' ARG . . . . . . . . . . . . . 7.1 ptp180 -142.23 151.24 41.91 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.565 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 235' ' ' HIS . . . . . 0.427 ' O ' ' CG ' ' B' ' 235' ' ' HIS . 4.9 p80 -168.74 73.66 0.79 Allowed Pre-proline 0 C--N 1.328 -0.349 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.474 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 236' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -53.47 -38.7 83.41 Favored 'Trans proline' 0 C--N 1.308 -1.571 0 C-N-CA 122.821 2.347 . . . . 0.0 112.103 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 237' ' ' SER . . . . . . . . . . . . . 73.2 m -129.68 152.79 48.8 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.468 -179.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 238' ' ' ALA . . . . . . . . . . . . . . . -63.48 -36.16 82.85 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.452 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.219 -0.827 0 CA-C-O 118.023 -1.432 . . . . 0.0 110.978 179.973 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.23 0 N-CA-C 109.596 -1.402 . . . . 0.0 109.596 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 99.1 m-70 45.97 79.49 0.05 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.794 0.33 . . . . 0.0 110.636 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -62.47 -42.02 99.73 Favored Glycine 0 CA--C 1.522 0.491 0 N-CA-C 110.855 -0.898 . . . . 0.0 110.855 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 35.6 m -137.96 160.56 33.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.872 0.368 . . . . 0.0 110.442 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -138.38 144.76 40.4 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.62 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 78.63 0.48 80.11 Favored Glycine 0 CA--C 1.52 0.352 0 N-CA-C 110.968 -0.853 . . . . 0.0 110.968 179.767 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 14.4 tpt180 -145.1 120.07 10.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.798 0.332 . . . . 0.0 110.571 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -153.82 126.04 7.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.689 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 67.1 ttt180 54.07 68.87 2.46 Favored Pre-proline 0 C--N 1.326 -0.421 0 CA-C-O 121.153 0.502 . . . . 0.0 110.643 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.426 ' O ' ' O ' ' A' ' 12' ' ' SER . 22.2 Cg_exo -63.83 146.86 92.24 Favored 'Trans proline' 0 C--N 1.306 -1.707 0 C-N-CA 122.854 2.369 . . . . 0.0 112.098 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.426 ' O ' ' O ' ' A' ' 11' ' ' PRO . 46.1 m 45.68 97.3 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.689 179.154 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.693 ' HB3' ' HD3' ' A' ' 14' ' ' PRO . . . -175.65 -61.9 0.0 OUTLIER Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.201 -179.495 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.693 ' HD3' ' HB3' ' A' ' 13' ' ' ALA . 25.1 Cg_endo -60.68 -31.3 91.88 Favored 'Trans proline' 0 C--N 1.31 -1.474 0 C-N-CA 122.619 2.213 . . . . 0.0 111.908 -179.757 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.563 ' O ' ' N ' ' A' ' 17' ' ' SER . 59.2 mt -106.58 86.0 2.26 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.25 -179.55 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 95.4 m-20 -37.17 -24.28 0.01 OUTLIER 'General case' 0 CA--C 1.528 0.111 0 O-C-N 123.45 0.469 . . . . 0.0 110.737 179.713 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.563 ' N ' ' O ' ' A' ' 15' ' ' LEU . 12.4 t -45.02 -48.17 11.6 Favored 'General case' 0 C--O 1.239 0.549 0 CA-C-O 121.164 0.507 . . . . 0.0 110.142 179.488 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 9.4 mp0 -64.53 -45.53 86.75 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.125 -0.488 . . . . 0.0 109.895 179.461 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.643 ' O ' HG23 ' A' ' 23' ' ' VAL . . . -56.14 -28.4 57.85 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.189 -0.46 . . . . 0.0 109.872 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.475 ' HB1' ' HB3' ' B' ' 155' ' ' LEU . . . -71.98 -49.54 36.4 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 110.108 -0.33 . . . . 0.0 110.108 179.429 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.03 -44.96 96.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.354 -179.803 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -60.96 -51.62 68.5 Favored 'General case' 0 C--O 1.242 0.671 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.701 -179.507 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.643 HG23 ' O ' ' A' ' 19' ' ' ALA . 98.8 t -60.49 -44.28 96.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.967 179.744 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.69 -42.14 78.56 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 120.804 -0.358 . . . . 0.0 110.201 179.525 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.2 m -59.2 -43.86 92.23 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.309 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.475 ' OG1' ' O ' ' A' ' 23' ' ' VAL . 30.6 p -64.83 -52.24 57.78 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 120.833 -0.347 . . . . 0.0 110.635 179.872 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.414 ' N ' ' CD1' ' A' ' 27' ' ' LEU . 7.6 mp -63.17 -21.58 66.3 Favored 'General case' 0 C--O 1.223 -0.295 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.787 179.493 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.553 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 64.0 tt0 -74.31 -59.91 2.51 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.688 179.391 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.62 -54.63 44.88 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.518 -179.478 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.505 ' O ' ' O ' ' A' ' 31' ' ' ALA . 8.5 mp -47.79 -32.42 5.99 Favored 'General case' 0 CA--C 1.515 -0.393 0 C-N-CA 120.956 -0.298 . . . . 0.0 110.387 -179.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.553 ' HB3' ' O ' ' A' ' 28' ' ' GLN . . . -56.84 -139.04 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.459 0 O-C-N 123.51 0.506 . . . . 0.0 110.247 179.711 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.485 ' O ' ' O ' ' A' ' 31' ' ' ALA . 7.1 m 56.54 117.35 0.01 OUTLIER Pre-proline 0 C--N 1.32 -0.695 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.347 179.659 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -48.37 -47.83 18.89 Favored 'Trans proline' 0 C--N 1.308 -1.561 0 C-N-CA 122.311 2.008 . . . . 0.0 112.824 -178.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 77.8 p -58.15 -48.71 79.42 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.977 -178.467 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.1 mmp_? -68.15 -36.58 79.9 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.584 179.893 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.518 HD13 ' O ' ' A' ' 36' ' ' LEU . 0.2 OUTLIER -61.34 -53.45 56.55 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.468 -0.493 . . . . 0.0 110.687 -178.367 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.453 ' C ' ' SD ' ' A' ' 37' ' ' MET . 0.9 OUTLIER -60.73 -45.77 93.0 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.473 179.967 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 86.8 mt -61.18 -43.56 96.62 Favored 'Isoleucine or valine' 0 C--O 1.242 0.66 0 CA-C-O 121.258 0.552 . . . . 0.0 110.394 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 34.5 mt -62.06 -40.59 96.29 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.519 179.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 99.0 m -59.92 -42.25 93.53 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.912 179.703 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.451 ' NE2' ' SD ' ' A' ' 37' ' ' MET . 45.7 mt-30 -58.23 -44.12 88.08 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.132 179.715 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.536 HD22 ' O ' ' A' ' 87' ' ' TYR . 19.4 mt -63.79 -42.92 97.65 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.897 178.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.518 HH12 ' C ' ' A' ' 98' ' ' LEU . 59.0 ttp180 -62.69 -35.88 81.12 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.323 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 14.3 t-20 -57.82 -41.42 82.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.607 -178.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 163.36 -175.96 39.58 Favored Glycine 0 CA--C 1.526 0.762 0 N-CA-C 110.972 -0.851 . . . . 0.0 110.972 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -74.58 135.03 19.35 Favored 'Trans proline' 0 N--CA 1.495 1.603 0 C-N-CA 122.812 2.341 . . . . 0.0 112.075 -179.533 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -157.02 98.82 2.01 Favored Pre-proline 0 CA--C 1.54 0.585 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.265 -178.833 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_exo -47.12 165.05 0.1 Allowed 'Trans proline' 0 C--N 1.301 -1.934 0 C-N-CA 122.321 2.014 . . . . 0.0 112.554 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 75.1 t -48.6 -43.48 13.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.693 -179.776 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 47.3 p -61.25 -39.86 91.91 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.504 179.569 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -64.71 -38.2 90.2 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.003 179.769 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.617 ' O ' HD13 ' A' ' 52' ' ' LEU . 0.2 OUTLIER -62.5 -46.84 86.62 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 120.42 -0.512 . . . . 0.0 110.223 179.811 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.525 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -55.18 -47.2 75.56 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.657 179.558 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 48.9 tp10 -55.38 -50.41 69.78 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.168 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.08 -58.22 7.21 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 120.7 -0.4 . . . . 0.0 110.767 -179.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 98.4 mt -85.7 -73.69 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.444 179.786 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . 0.525 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 131.62 94.51 0.63 Allowed Glycine 0 N--CA 1.461 0.358 0 N-CA-C 111.163 -0.775 . . . . 0.0 111.163 179.695 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 84.6 mmm 67.54 84.27 0.16 Allowed 'General case' 0 CA--C 1.521 -0.161 0 CA-C-O 120.829 0.347 . . . . 0.0 111.025 178.593 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 15.2 tt0 -169.32 28.15 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.275 179.588 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -66.45 -23.83 66.34 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.78 -179.335 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 15.5 t -66.06 -44.46 84.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.132 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.531 ' O ' ' NE2' ' A' ' 66' ' ' GLN . . . -63.4 -31.98 73.28 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.327 -179.695 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 60.2 t -72.6 -53.81 18.04 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.242 0 C-N-CA 120.746 -0.382 . . . . 0.0 110.647 -179.457 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 79.7 p -58.13 -40.3 80.94 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.909 -0.317 . . . . 0.0 110.165 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . 0.41 ' ND1' ' OE1' ' A' ' 66' ' ' GLN . 50.4 t-80 -65.86 -51.21 60.74 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.087 0.47 . . . . 0.0 110.845 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.531 ' NE2' ' O ' ' A' ' 62' ' ' ALA . 0.7 OUTLIER -61.9 -39.55 92.35 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.287 179.765 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.497 HD21 ' CE1' ' A' ' 87' ' ' TYR . 23.6 tp -61.8 -44.3 97.14 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.236 -179.49 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 21.0 mmt85 -61.67 -41.64 97.83 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 120.795 0.331 . . . . 0.0 110.516 -179.376 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.404 HG23 ' O ' ' A' ' 65' ' ' HIS . 94.0 t -61.2 -55.01 27.48 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.222 0 C-N-CA 120.224 -0.59 . . . . 0.0 110.262 -179.522 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 10.5 mp -62.0 -39.57 92.68 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 179.392 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 78.1 ttt-85 -51.96 -42.67 63.07 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.003 -179.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -60.63 -45.57 93.54 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.638 -0.425 . . . . 0.0 110.25 179.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.8 mt -65.84 -38.71 89.59 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.134 179.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 91.33 32.75 8.53 Favored Glycine 0 CA--C 1.522 0.522 0 N-CA-C 110.905 -0.878 . . . . 0.0 110.905 -179.534 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 91.2 mt -95.85 -1.33 49.71 Favored 'General case' 0 CA--C 1.519 -0.232 0 O-C-N 122.86 -0.2 . . . . 0.0 110.597 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.402 ' HA ' ' H ' ' A' ' 90' ' ' TYR . 26.8 m -134.28 155.97 39.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.191 -179.877 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 73.0 t -124.95 137.61 56.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.146 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -119.89 129.87 8.17 Favored Glycine 0 N--CA 1.465 0.589 0 N-CA-C 110.734 -0.946 . . . . 0.0 110.734 179.353 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -107.62 99.07 8.59 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 110.304 -0.258 . . . . 0.0 110.304 -179.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 73.0 ttt180 -85.29 125.96 33.33 Favored 'General case' 0 CA--C 1.519 -0.219 0 O-C-N 123.476 0.485 . . . . 0.0 110.413 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -173.15 144.13 1.19 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.712 179.775 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.496 ' O ' ' N ' ' A' ' 84' ' ' SER . . . 44.58 69.02 0.79 Allowed Glycine 0 C--N 1.329 0.19 0 N-CA-C 110.741 -0.944 . . . . 0.0 110.741 179.659 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.439 ' C ' ' O ' ' A' ' 82' ' ' GLY . 14.8 ptp180 32.76 34.09 0.01 OUTLIER 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.892 0.377 . . . . 0.0 110.857 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . 0.496 ' N ' ' O ' ' A' ' 82' ' ' GLY . 54.7 p -144.02 122.69 12.56 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.18 -179.197 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 1.9 tp -114.87 124.88 71.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.11 179.746 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 99.5 t -101.14 121.36 51.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.577 178.506 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.536 ' O ' HD22 ' A' ' 42' ' ' LEU . 65.4 m-85 -98.62 125.2 43.81 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.133 179.768 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 86.7 p -142.24 160.62 39.89 Favored 'General case' 0 C--O 1.224 -0.271 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.438 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 7.3 mt -72.73 136.69 45.57 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.633 -179.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.468 ' CD1' ' C ' ' A' ' 90' ' ' TYR . 20.8 t80 -62.59 -51.52 67.0 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.743 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.5 m-20 -83.58 143.06 30.4 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.526 -179.409 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 98.9 m -94.21 -25.82 16.92 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.357 179.091 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . 0.62 ' CG ' ' ND1' ' B' ' 223' ' ' HIS . 77.9 m-70 -58.23 -44.04 88.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.363 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.531 HG23 ' N ' ' A' ' 95' ' ' ALA . 20.0 m -56.04 -42.01 70.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.021 -179.862 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.531 ' N ' HG23 ' A' ' 94' ' ' VAL . . . -60.88 -45.97 92.46 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.997 0.427 . . . . 0.0 110.28 179.035 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 67.1 tp60 -62.04 -41.52 98.21 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.106 179.34 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.423 HD11 ' HG ' ' B' ' 216' ' ' LEU . 11.3 tp -58.56 -44.4 89.7 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.22 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.518 ' C ' HH12 ' A' ' 43' ' ' ARG . 87.1 mt -63.24 -39.54 94.91 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.227 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . 0.494 ' N ' ' NH1' ' A' ' 43' ' ' ARG . 52.1 m-20 -59.36 -41.24 88.82 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.747 0.308 . . . . 0.0 110.527 -179.481 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -69.53 -54.41 14.28 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.993 179.456 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.12 -43.23 91.94 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.443 -179.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.401 ' CG1' ' O ' ' A' ' 98' ' ' LEU . 4.1 mm -61.68 -45.54 98.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.328 -179.283 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 87.7 t80 -60.2 -39.7 87.47 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.865 0.365 . . . . 0.0 110.275 179.594 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . 0.574 ' ND1' ' CG ' ' B' ' 212' ' ' HIS . 57.6 t60 -63.76 -39.34 94.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.747 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.508 ' O ' HD13 ' A' ' 108' ' ' LEU . 29.8 t -75.7 -42.8 49.91 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.895 179.744 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 11.6 tm-20 -60.08 -37.86 81.17 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.495 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . 0.629 ' O ' ' N ' ' A' ' 109' ' ' HIS . 82.2 t60 -50.56 -70.13 0.09 Allowed 'General case' 0 CA--C 1.508 -0.647 0 CA-C-N 116.114 -0.493 . . . . 0.0 109.887 -179.048 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.527 ' O ' ' N ' ' A' ' 110' ' ' LEU . 1.0 OUTLIER 32.02 -83.82 0.0 OUTLIER 'General case' 0 CA--C 1.515 -0.4 0 O-C-N 123.32 0.388 . . . . 0.0 111.41 179.947 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . 0.629 ' N ' ' O ' ' A' ' 107' ' ' HIS . 37.4 m80 64.65 -45.2 0.32 Allowed 'General case' 0 C--N 1.332 -0.155 0 O-C-N 124.423 1.077 . . . . 0.0 110.188 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.527 ' N ' ' O ' ' A' ' 108' ' ' LEU . 82.6 mt -63.72 -42.15 97.96 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.766 179.709 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 75.95 77.7 0.72 Allowed Glycine 0 CA--C 1.525 0.669 0 N-CA-C 111.16 -0.776 . . . . 0.0 111.16 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.61 ' N ' HD22 ' A' ' 112' ' ' LEU . 3.5 mm? -76.51 142.39 40.91 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.828 0.347 . . . . 0.0 110.721 -179.738 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 4.0 m -50.82 87.7 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.42 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . 0.511 ' N ' ' O ' ' A' ' 112' ' ' LEU . 96.6 m-20 -88.3 151.42 22.64 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.492 179.835 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.406 ' H ' ' HG2' ' A' ' 115' ' ' ARG . 23.6 ptt180 -71.24 171.36 11.22 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.393 179.812 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . 0.404 ' O ' ' CG ' ' A' ' 116' ' ' HIS . 82.1 t60 -133.55 66.06 73.05 Favored Pre-proline 0 N--CA 1.465 0.279 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.476 -179.822 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -76.29 155.26 37.0 Favored 'Trans proline' 0 C--N 1.307 -1.644 0 C-N-CA 122.813 2.342 . . . . 0.0 112.028 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . 0.429 ' O ' ' O ' ' A' ' 119' ' ' ALA . 35.5 t -151.59 88.04 1.4 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.512 179.468 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . 0.429 ' O ' ' O ' ' A' ' 118' ' ' SER . . . 40.61 -163.29 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.751 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.676 0 CA-C-O 117.931 -1.483 . . . . 0.0 110.872 179.862 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.305 0 N-CA-C 109.488 -1.445 . . . . 0.0 109.488 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 98.8 m-70 49.11 80.17 0.07 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.772 0.32 . . . . 0.0 110.551 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 123' ' ' GLY . . . . . . . . . . . . . . . -64.01 -40.64 98.39 Favored Glycine 0 CA--C 1.521 0.432 0 N-CA-C 111.01 -0.836 . . . . 0.0 111.01 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 31.2 m -137.68 159.66 34.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.811 0.339 . . . . 0.0 110.492 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 125' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -138.98 143.07 38.36 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.949 0.404 . . . . 0.0 110.555 179.77 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 79.51 0.89 85.43 Favored Glycine 0 CA--C 1.52 0.349 0 N-CA-C 110.971 -0.851 . . . . 0.0 110.971 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 127' ' ' ARG . . . . . . . . . . . . . 14.8 tpt180 -145.8 119.68 9.32 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.821 0.344 . . . . 0.0 110.618 179.765 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 128' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -155.29 125.45 6.69 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.639 179.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 129' ' ' ARG . . . . . . . . . . . . . 60.8 ttt180 53.96 62.39 9.0 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.526 179.765 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -67.98 146.88 72.76 Favored 'Trans proline' 0 C--N 1.308 -1.57 0 C-N-CA 122.717 2.278 . . . . 0.0 111.923 -179.815 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 27.0 m 55.08 86.76 0.05 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.601 179.497 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 132' ' ' ALA . . . . . 0.667 ' HB3' ' HD3' ' B' ' 133' ' ' PRO . . . -172.66 -62.0 0.0 OUTLIER Pre-proline 0 C--N 1.325 -0.487 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.312 -179.312 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 133' ' ' PRO . . . . . 0.667 ' HD3' ' HB3' ' B' ' 132' ' ' ALA . 19.8 Cg_endo -59.39 -31.65 95.23 Favored 'Trans proline' 0 C--N 1.31 -1.462 0 C-N-CA 122.615 2.21 . . . . 0.0 111.886 -179.395 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . 0.563 ' O ' ' N ' ' B' ' 136' ' ' SER . 57.5 mt -106.38 86.8 2.41 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.16 -179.531 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 94.3 m-20 -37.32 -24.68 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.172 0 O-C-N 123.44 0.462 . . . . 0.0 110.646 179.78 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . 0.563 ' N ' ' O ' ' B' ' 134' ' ' LEU . 44.1 t -44.32 -49.31 9.53 Favored 'General case' 0 C--O 1.241 0.622 0 CA-C-O 121.088 0.47 . . . . 0.0 110.356 179.265 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 9.5 mp0 -64.19 -45.29 88.99 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.058 179.543 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 138' ' ' ALA . . . . . 0.631 ' O ' HG23 ' B' ' 142' ' ' VAL . . . -56.3 -28.65 59.49 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.189 -0.459 . . . . 0.0 109.872 179.849 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -71.66 -49.93 35.24 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 179.569 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -60.74 -45.48 94.12 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.338 -179.876 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -60.44 -51.56 68.94 Favored 'General case' 0 C--O 1.24 0.583 0 CA-C-O 121.134 0.492 . . . . 0.0 110.652 -179.361 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 142' ' ' VAL . . . . . 0.631 HG23 ' O ' ' B' ' 138' ' ' ALA . 95.1 t -60.42 -44.24 95.76 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.308 0 CA-C-N 115.888 -0.597 . . . . 0.0 109.993 179.786 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -56.86 -42.13 79.19 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.733 0.301 . . . . 0.0 110.274 179.69 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 70.4 m -59.08 -44.38 91.88 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.377 -179.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 145' ' ' THR . . . . . 0.48 ' OG1' ' O ' ' B' ' 142' ' ' VAL . 35.4 p -64.33 -51.37 63.73 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.702 179.753 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 146' ' ' LEU . . . . . 0.403 ' N ' ' CD1' ' B' ' 146' ' ' LEU . 7.6 mp -63.68 -21.51 66.42 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.805 179.502 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 147' ' ' GLN . . . . . 0.568 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 57.7 tt0 -74.68 -59.59 2.66 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.709 179.418 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -58.33 -54.77 43.2 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.685 -179.476 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.478 ' O ' ' O ' ' B' ' 150' ' ' ALA . 8.7 mp -48.42 -30.57 5.19 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.914 -0.314 . . . . 0.0 110.392 -179.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 150' ' ' ALA . . . . . 0.568 ' HB3' ' O ' ' B' ' 147' ' ' GLN . . . -58.08 -138.33 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.456 0 O-C-N 123.611 0.569 . . . . 0.0 110.144 179.702 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 151' ' ' THR . . . . . 0.482 ' O ' ' O ' ' B' ' 150' ' ' ALA . 27.2 m 56.1 117.37 0.01 OUTLIER Pre-proline 0 C--N 1.323 -0.557 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.438 179.636 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -48.25 -47.83 18.61 Favored 'Trans proline' 0 C--N 1.307 -1.624 0 C-N-CA 122.281 1.988 . . . . 0.0 112.901 -179.115 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 77.4 p -58.18 -48.92 78.81 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.933 -178.435 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 154' ' ' ARG . . . . . 0.412 HH21 HG21 ' B' ' 157' ' ' ILE . 1.1 mmp_? -67.39 -37.04 82.51 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.598 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 155' ' ' LEU . . . . . 0.515 ' O ' HD13 ' B' ' 155' ' ' LEU . 0.2 OUTLIER -60.24 -53.19 60.63 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.399 -0.52 . . . . 0.0 110.714 -178.347 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 156' ' ' MET . . . . . 0.457 ' C ' ' SD ' ' B' ' 156' ' ' MET . 1.0 OUTLIER -61.15 -45.65 93.77 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.452 179.981 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 157' ' ' ILE . . . . . 0.412 HG21 HH21 ' B' ' 154' ' ' ARG . 92.6 mt -60.93 -43.75 96.51 Favored 'Isoleucine or valine' 0 C--O 1.242 0.667 0 CA-C-O 121.227 0.537 . . . . 0.0 110.434 -179.616 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 17.0 mt -62.29 -40.13 95.27 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.395 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 19.7 m -59.87 -43.2 94.84 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.158 179.551 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 160' ' ' GLN . . . . . 0.446 ' NE2' ' SD ' ' B' ' 156' ' ' MET . 45.0 mt-30 -57.9 -44.25 86.64 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.077 179.72 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 161' ' ' LEU . . . . . 0.53 HD22 ' O ' ' B' ' 206' ' ' TYR . 20.0 mt -63.95 -42.89 97.17 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.915 179.02 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 162' ' ' ARG . . . . . 0.53 HH12 ' C ' ' B' ' 217' ' ' LEU . 58.7 ttp180 -62.9 -35.45 80.09 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.253 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 17.1 t-20 -58.19 -44.61 88.16 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.747 -178.649 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . 167.46 -174.86 42.6 Favored Glycine 0 CA--C 1.526 0.777 0 N-CA-C 110.989 -0.844 . . . . 0.0 110.989 179.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -75.51 133.23 15.61 Favored 'Trans proline' 0 N--CA 1.494 1.543 0 C-N-CA 122.839 2.359 . . . . 0.0 111.997 -179.728 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -155.41 99.08 2.3 Favored Pre-proline 0 CA--C 1.539 0.555 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.275 -178.882 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_exo -47.56 165.28 0.12 Allowed 'Trans proline' 0 C--N 1.3 -2.015 0 C-N-CA 122.45 2.1 . . . . 0.0 112.411 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . 87.5 t -48.75 -43.4 14.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.68 -179.683 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 169' ' ' THR . . . . . . . . . . . . . 63.4 p -61.45 -39.52 91.14 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.446 179.613 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.83 -38.63 91.64 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.151 179.516 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 171' ' ' LEU . . . . . 0.607 ' O ' HD13 ' B' ' 171' ' ' LEU . 0.2 OUTLIER -62.29 -46.56 88.21 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 120.309 -0.556 . . . . 0.0 110.149 179.771 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 172' ' ' ALA . . . . . 0.55 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -55.45 -47.18 76.46 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 179.435 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 43.8 tp10 -55.43 -50.56 69.48 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.424 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -52.0 -57.22 10.12 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 120.81 -0.356 . . . . 0.0 110.774 -179.592 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 175' ' ' ILE . . . . . 0.452 HD13 ' OE1' ' B' ' 178' ' ' GLU . 99.1 mt -87.1 -70.99 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.522 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 176' ' ' GLY . . . . . 0.55 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 128.14 94.36 0.81 Allowed Glycine 0 N--CA 1.461 0.357 0 N-CA-C 111.136 -0.786 . . . . 0.0 111.136 179.696 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 83.8 mmm 68.96 86.46 0.13 Allowed 'General case' 0 C--N 1.34 0.189 0 C-N-CA 120.899 -0.32 . . . . 0.0 110.981 178.388 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 178' ' ' GLU . . . . . 0.46 ' HG2' ' HB3' ' B' ' 181' ' ' ALA . 47.3 tt0 -172.53 28.01 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.193 179.306 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 72.5 mt-30 -66.75 -23.8 66.13 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.762 -179.531 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 11.9 t -66.53 -44.12 83.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.028 -179.721 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 181' ' ' ALA . . . . . 0.522 ' O ' ' NE2' ' B' ' 185' ' ' GLN . . . -63.7 -32.39 73.86 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.482 -179.765 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 65.0 t -71.94 -53.56 19.73 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 C-N-CA 120.664 -0.414 . . . . 0.0 110.655 -179.314 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 77.5 p -58.36 -39.92 80.85 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.91 -0.316 . . . . 0.0 110.247 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 184' ' ' HIS . . . . . 0.4 ' ND1' ' OE1' ' B' ' 185' ' ' GLN . 49.6 t-80 -65.68 -51.11 62.0 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.714 179.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 185' ' ' GLN . . . . . 0.522 ' NE2' ' O ' ' B' ' 181' ' ' ALA . 0.8 OUTLIER -62.23 -40.62 96.73 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.36 179.835 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 186' ' ' LEU . . . . . 0.434 HD21 ' CE1' ' B' ' 206' ' ' TYR . 17.5 tp -60.67 -44.61 96.28 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.105 -179.651 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 21.5 mmt85 -60.99 -41.84 97.26 Favored 'General case' 0 C--O 1.24 0.563 0 CA-C-O 120.81 0.338 . . . . 0.0 110.546 -179.513 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 87.9 t -61.14 -54.93 28.51 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.177 0 C-N-CA 120.25 -0.58 . . . . 0.0 110.19 -179.517 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 10.5 mp -62.0 -39.68 93.08 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 110.152 -0.314 . . . . 0.0 110.152 179.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 77.1 ttt-85 -51.48 -42.9 61.96 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.03 -179.488 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 55.4 t30 -60.57 -45.57 93.43 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.461 179.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 192' ' ' LEU . . . . . . . . . . . . . 10.1 mt -65.26 -39.36 92.53 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.196 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 91.6 33.2 8.09 Favored Glycine 0 CA--C 1.524 0.61 0 N-CA-C 110.821 -0.912 . . . . 0.0 110.821 -179.62 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 77.8 mt -97.33 -0.74 45.94 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.513 0.197 . . . . 0.0 110.632 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 24.9 m -134.26 155.58 39.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.263 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 196' ' ' VAL . . . . . . . . . . . . . 76.1 t -125.57 138.98 52.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.128 -179.876 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 197' ' ' GLY . . . . . . . . . . . . . . . -121.65 130.66 8.19 Favored Glycine 0 N--CA 1.464 0.548 0 N-CA-C 110.823 -0.911 . . . . 0.0 110.823 179.697 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -107.8 99.64 9.09 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 110.305 -0.257 . . . . 0.0 110.305 -179.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 72.7 ttt180 -85.23 126.46 33.69 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.399 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 200' ' ' ALA . . . . . . . . . . . . . . . -173.32 144.5 1.19 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.687 179.614 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 201' ' ' GLY . . . . . 0.518 ' O ' ' N ' ' B' ' 203' ' ' SER . . . 43.63 69.2 0.7 Allowed Glycine 0 C--N 1.329 0.191 0 N-CA-C 110.779 -0.929 . . . . 0.0 110.779 179.771 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 202' ' ' ARG . . . . . 0.432 ' C ' ' O ' ' B' ' 201' ' ' GLY . 15.3 ptp180 33.46 32.6 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.915 0.388 . . . . 0.0 110.869 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 203' ' ' SER . . . . . 0.518 ' N ' ' O ' ' B' ' 201' ' ' GLY . 54.6 p -142.64 123.07 13.97 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.163 -179.163 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 1.8 tp -115.64 123.86 71.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.061 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 89.5 t -99.83 120.96 49.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.609 178.496 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 206' ' ' TYR . . . . . 0.53 ' O ' HD22 ' B' ' 161' ' ' LEU . 68.6 m-85 -98.18 125.36 43.19 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.309 179.819 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 34.2 p -142.68 160.69 39.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.335 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . 6.0 mt -73.17 138.07 45.47 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.751 -179.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 209' ' ' TYR . . . . . 0.461 ' C ' ' CD1' ' B' ' 209' ' ' TYR . 22.3 t80 -63.46 -52.39 61.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.801 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 43.1 m-20 -82.7 142.5 31.61 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.474 -179.339 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 99.3 m -94.6 -24.06 17.37 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-O 121.068 0.461 . . . . 0.0 110.33 179.223 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 212' ' ' HIS . . . . . 0.574 ' CG ' ' ND1' ' A' ' 104' ' ' HIS . 85.6 m-70 -59.5 -43.79 93.27 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.211 179.755 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 213' ' ' VAL . . . . . 0.554 HG23 ' N ' ' B' ' 214' ' ' ALA . 15.5 m -56.1 -42.77 73.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.021 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 214' ' ' ALA . . . . . 0.554 ' N ' HG23 ' B' ' 213' ' ' VAL . . . -59.9 -46.41 89.44 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.188 179.013 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 68.4 tp60 -61.36 -41.15 96.6 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.019 179.497 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 216' ' ' LEU . . . . . 0.423 ' HG ' HD11 ' A' ' 97' ' ' LEU . 10.0 tp -59.04 -43.99 91.71 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.268 -179.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 217' ' ' LEU . . . . . 0.53 ' C ' HH12 ' B' ' 162' ' ' ARG . 91.3 mt -63.51 -38.96 93.14 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.229 179.709 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 218' ' ' ASP . . . . . 0.478 ' N ' ' NH1' ' B' ' 162' ' ' ARG . 69.3 m-20 -59.66 -41.55 90.84 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.889 0.376 . . . . 0.0 110.603 -179.52 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 219' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -69.52 -54.92 11.81 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.984 179.581 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -58.15 -43.76 87.55 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.4 -179.686 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 221' ' ' ILE . . . . . 0.414 ' CG1' ' O ' ' B' ' 217' ' ' LEU . 4.1 mm -61.47 -45.91 97.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.388 -178.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 86.5 t80 -60.94 -40.14 92.13 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.244 179.757 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 223' ' ' HIS . . . . . 0.62 ' ND1' ' CG ' ' A' ' 93' ' ' HIS . 41.4 t60 -61.5 -41.92 98.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.032 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 224' ' ' SER . . . . . 0.573 ' O ' HD13 ' B' ' 227' ' ' LEU . 35.6 t -73.63 -40.79 63.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.013 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 225' ' ' GLU . . . . . 0.404 ' C ' ' H ' ' B' ' 227' ' ' LEU . 11.4 tm-20 -65.29 -31.38 72.49 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.708 -179.746 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 226' ' ' HIS . . . . . 0.524 ' O ' ' CD2' ' B' ' 226' ' ' HIS . 76.2 t60 -68.94 3.84 1.81 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.689 -179.52 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 227' ' ' LEU . . . . . 0.573 HD13 ' O ' ' B' ' 224' ' ' SER . 0.6 OUTLIER -40.01 -72.39 0.06 Allowed 'General case' 0 CA--C 1.513 -0.471 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.716 -179.818 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 228' ' ' HIS . . . . . . . . . . . . . 36.6 m80 62.73 -56.31 0.15 Allowed 'General case' 0 C--N 1.334 -0.095 0 O-C-N 124.23 0.956 . . . . 0.0 110.997 179.666 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 229' ' ' LEU . . . . . 0.506 ' N ' ' O ' ' B' ' 227' ' ' LEU . 73.6 mt -58.57 -42.2 87.4 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.598 -179.299 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . 72.83 79.34 0.48 Allowed Glycine 0 CA--C 1.522 0.504 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 179.515 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 231' ' ' LEU . . . . . 0.594 HD22 ' N ' ' B' ' 231' ' ' LEU . 3.7 mm? -76.0 143.94 41.2 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.658 0.266 . . . . 0.0 110.737 -179.842 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 232' ' ' SER . . . . . . . . . . . . . 4.7 m -50.23 87.8 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.405 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 233' ' ' ASP . . . . . 0.512 ' N ' ' O ' ' B' ' 231' ' ' LEU . 97.1 m-20 -88.46 156.09 19.31 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.455 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 234' ' ' ARG . . . . . . . . . . . . . 23.6 ptt180 -75.84 171.18 14.84 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.451 179.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 235' ' ' HIS . . . . . . . . . . . . . 83.7 t60 -132.85 66.42 76.32 Favored Pre-proline 0 N--CA 1.465 0.293 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.533 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 236' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -75.76 156.67 39.68 Favored 'Trans proline' 0 C--N 1.308 -1.592 0 C-N-CA 122.908 2.406 . . . . 0.0 112.026 179.65 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 237' ' ' SER . . . . . 0.429 ' O ' ' O ' ' B' ' 238' ' ' ALA . 23.2 t -153.68 86.67 1.2 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.525 179.443 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 238' ' ' ALA . . . . . 0.429 ' O ' ' O ' ' B' ' 237' ' ' SER . . . 41.91 -165.5 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.654 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.219 -0.796 0 CA-C-O 117.984 -1.453 . . . . 0.0 110.843 179.938 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . 0.404 ' O ' HG13 ' A' ' 5' ' ' VAL . . . . . . . . 0 N--CA 1.491 2.303 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 71.4 t60 -83.94 -5.96 59.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.806 0.336 . . . . 0.0 110.562 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -76.51 2.49 57.99 Favored Glycine 0 CA--C 1.524 0.601 0 N-CA-C 110.968 -0.853 . . . . 0.0 110.968 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.404 HG13 ' O ' ' A' ' 2' ' ' GLY . 27.7 m -64.92 -33.93 66.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 120.948 0.404 . . . . 0.0 110.774 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -62.89 140.49 58.82 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.654 -179.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -177.57 -115.47 0.44 Allowed Glycine 0 CA--C 1.524 0.615 0 N-CA-C 110.945 -0.862 . . . . 0.0 110.945 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.517 ' NH2' ' NH1' ' A' ' 10' ' ' ARG . 84.8 mtp180 -79.46 -9.29 59.58 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.781 0.324 . . . . 0.0 110.521 -179.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 65.6 t30 59.59 40.32 20.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.372 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.517 ' NH1' ' NH2' ' A' ' 8' ' ' ARG . 72.3 mtt180 -110.62 150.24 41.44 Favored Pre-proline 0 C--O 1.233 0.193 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.53 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -68.06 153.38 75.15 Favored 'Trans proline' 0 C--N 1.31 -1.447 0 C-N-CA 122.684 2.256 . . . . 0.0 112.057 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 86.4 p -142.34 87.06 1.99 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.317 179.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -169.42 61.73 0.44 Allowed Pre-proline 0 C--N 1.331 -0.213 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.362 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -72.4 113.99 3.87 Favored 'Trans proline' 0 N--CA 1.494 1.552 0 C-N-CA 122.667 2.245 . . . . 0.0 111.85 -179.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.545 ' O ' ' N ' ' A' ' 17' ' ' SER . 38.7 mt -77.6 -143.99 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.277 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 93.7 m-20 -42.43 -17.7 0.01 OUTLIER 'General case' 0 C--O 1.224 -0.267 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.7 179.808 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.545 ' N ' ' O ' ' A' ' 15' ' ' LEU . 47.6 t -38.74 -49.91 1.62 Allowed 'General case' 0 C--O 1.239 0.518 0 CA-C-O 121.383 0.611 . . . . 0.0 110.606 -179.661 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.408 ' HG2' ' H ' ' A' ' 18' ' ' GLN . 3.0 pt20 -64.64 -46.43 82.57 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.003 179.319 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.632 ' O ' HG23 ' A' ' 23' ' ' VAL . . . -58.43 -28.65 65.46 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.221 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.464 ' HB1' ' HB3' ' B' ' 155' ' ' LEU . . . -70.97 -51.0 28.23 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-O 120.888 0.375 . . . . 0.0 110.128 179.834 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.49 -40.53 96.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.557 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.468 HE22 HG23 ' A' ' 26' ' ' THR . 5.4 tm0? -62.31 -50.43 71.67 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-O 121.417 0.627 . . . . 0.0 110.444 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.632 HG23 ' O ' ' A' ' 19' ' ' ALA . 93.9 t -61.74 -43.36 97.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.98 179.712 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.71 -41.4 81.67 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 58.9 m -59.47 -45.25 92.16 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.154 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.468 HG23 HE22 ' A' ' 22' ' ' GLN . 22.6 p -63.99 -44.58 92.26 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-O 120.937 0.398 . . . . 0.0 110.442 179.551 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 95.9 mt -67.13 -21.73 65.83 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.332 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.49 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 60.1 tt0 -74.49 -58.18 3.45 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.274 179.71 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.98 -55.19 31.9 Favored 'General case' 0 CA--C 1.52 -0.205 0 C-N-CA 120.511 -0.476 . . . . 0.0 110.276 -179.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.487 ' O ' ' O ' ' A' ' 31' ' ' ALA . 50.3 tp -43.94 -32.34 1.1 Allowed 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 110.12 -0.326 . . . . 0.0 110.12 -178.524 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.49 ' HB3' ' O ' ' A' ' 28' ' ' GLN . . . -58.24 -136.2 0.0 OUTLIER 'General case' 0 C--O 1.218 -0.6 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.84 178.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.453 ' O ' ' O ' ' A' ' 31' ' ' ALA . 9.4 m 55.12 113.15 0.02 OUTLIER Pre-proline 0 CA--C 1.538 0.488 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.836 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_exo -47.84 -45.77 23.45 Favored 'Trans proline' 0 C--N 1.309 -1.505 0 C-N-CA 122.395 2.064 . . . . 0.0 113.247 -179.211 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 51.7 m -54.14 -42.89 70.04 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.132 0.492 . . . . 0.0 111.188 -179.338 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.5 mmp_? -68.39 -34.42 76.01 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.066 179.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.49 ' O ' HG23 ' A' ' 40' ' ' THR . 3.6 mm? -64.55 -56.23 15.39 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.431 -0.508 . . . . 0.0 111.84 -179.025 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.493 ' O ' ' OG1' ' A' ' 40' ' ' THR . 3.3 ptm -58.26 -44.06 88.19 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.092 0.473 . . . . 0.0 110.037 179.752 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 92.4 mt -64.02 -43.9 97.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 121.492 0.663 . . . . 0.0 110.144 179.11 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.483 HD11 HD21 ' A' ' 89' ' ' LEU . 64.0 tp -59.51 -41.17 89.31 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.927 -179.575 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.493 ' OG1' ' O ' ' A' ' 37' ' ' MET . 41.4 p -63.93 -35.78 81.78 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.309 -179.754 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 89.8 mm-40 -63.61 -50.81 67.93 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 120.501 -0.48 . . . . 0.0 110.245 179.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 78.9 mt -63.44 -32.86 74.42 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.666 179.721 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 61.5 ttp180 -53.16 -39.49 63.61 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.197 -179.44 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 43.0 t-20 -61.92 -41.1 97.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.815 0.34 . . . . 0.0 110.593 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 168.5 177.62 39.64 Favored Glycine 0 CA--C 1.527 0.785 0 N-CA-C 111.016 -0.833 . . . . 0.0 111.016 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_endo -69.43 152.38 71.03 Favored 'Trans proline' 0 C--N 1.309 -1.503 0 C-N-CA 122.893 2.395 . . . . 0.0 111.897 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 1.3 pp 178.59 148.28 0.39 Allowed Pre-proline 0 N--CA 1.451 -0.418 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.789 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -72.63 -175.66 1.94 Allowed 'Trans proline' 0 N--CA 1.494 1.547 0 C-N-CA 122.756 2.304 . . . . 0.0 112.208 178.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.765 HG23 ' H ' ' A' ' 50' ' ' THR . 33.1 m -75.79 -61.42 1.7 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.582 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.912 179.471 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.765 ' H ' HG23 ' A' ' 49' ' ' VAL . 71.8 p -29.32 -46.1 0.05 Allowed 'General case' 0 N--CA 1.475 0.801 0 CA-C-O 121.464 0.649 . . . . 0.0 110.362 -179.449 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -62.33 -43.55 98.55 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.099 178.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.695 ' N ' ' O ' ' A' ' 49' ' ' VAL . 0.2 OUTLIER -61.33 -38.62 87.57 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.846 -179.754 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.533 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -61.53 -43.85 98.12 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.635 -0.505 . . . . 0.0 109.635 179.712 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -57.0 -46.48 82.24 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 179.628 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.28 -49.46 77.74 Favored 'General case' 0 C--O 1.231 0.094 0 C-N-CA 120.73 -0.388 . . . . 0.0 110.248 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 96.3 mt -92.7 -79.22 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.346 179.502 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . 0.533 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 141.76 89.73 0.14 Allowed Glycine 0 CA--C 1.519 0.331 0 N-CA-C 111.171 -0.772 . . . . 0.0 111.171 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 32.0 ttp 69.23 105.94 0.06 Allowed 'General case' 0 CA--C 1.52 -0.21 0 CA-C-O 120.53 0.205 . . . . 0.0 110.682 179.261 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 176.05 10.98 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.528 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -53.8 -37.56 63.64 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.705 -179.293 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 4.8 t -61.45 -48.94 78.83 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.951 -179.548 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.4 -35.68 68.05 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.224 -179.748 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 90.2 t -69.42 -52.96 27.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 C-N-CA 120.524 -0.47 . . . . 0.0 110.778 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 78.3 p -56.32 -43.32 78.88 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.876 0.369 . . . . 0.0 110.53 -179.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 55.9 t-80 -63.76 -51.07 66.51 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.019 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -61.04 -38.4 86.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.417 179.708 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.409 HD21 ' CD1' ' A' ' 87' ' ' TYR . 54.4 tp -60.84 -45.35 94.83 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.428 -179.81 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 74.1 ttt180 -60.77 -45.37 94.62 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-O 121.091 0.472 . . . . 0.0 110.509 -179.521 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 91.4 t -65.54 -54.5 27.53 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.386 0 C-N-CA 120.203 -0.599 . . . . 0.0 110.583 -179.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 97.7 mt -56.37 -40.73 75.04 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 -179.435 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 59.1 ttt85 -57.83 -39.64 78.15 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.26 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 97.6 m-20 -62.24 -43.54 98.59 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 120.548 -0.461 . . . . 0.0 110.594 -179.464 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.474 HD23 ' N ' ' A' ' 73' ' ' LEU . 7.0 mt -65.9 -44.72 84.4 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-O 120.953 0.406 . . . . 0.0 110.587 -179.29 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 104.15 96.56 2.41 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 111.612 -0.595 . . . . 0.0 111.612 179.606 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -171.92 -6.11 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.898 0.38 . . . . 0.0 110.654 179.205 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 30.8 m -138.83 157.62 29.52 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.19 179.656 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.423 HG12 ' N ' ' A' ' 78' ' ' GLY . 61.2 t -143.82 155.59 15.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.432 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.423 ' N ' HG12 ' A' ' 77' ' ' VAL . . . -126.41 144.89 15.4 Favored Glycine 0 N--CA 1.462 0.429 0 N-CA-C 110.446 -1.062 . . . . 0.0 110.446 179.378 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 -103.56 117.48 34.51 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 110.349 -0.241 . . . . 0.0 110.349 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 61.7 ttp180 -96.82 136.6 37.14 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.541 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -145.5 95.66 2.7 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.628 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 60.61 -85.83 0.02 OUTLIER Glycine 0 CA--C 1.523 0.563 0 N-CA-C 110.71 -0.956 . . . . 0.0 110.71 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 85.0 mtp180 -129.45 12.29 5.92 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.615 0.245 . . . . 0.0 110.648 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 50.6 m -117.47 108.84 16.01 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-O 120.914 0.387 . . . . 0.0 110.485 179.861 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 2.7 tp -117.34 130.46 72.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.832 179.57 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 20.1 m -123.05 159.39 27.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.355 179.146 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.409 ' CD1' HD21 ' A' ' 67' ' ' LEU . 27.7 m-85 -115.75 136.58 52.91 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.463 -179.66 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 20.1 m -151.07 171.95 16.51 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.193 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.614 ' N ' HD12 ' A' ' 89' ' ' LEU . 8.3 mp -74.8 146.64 41.89 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.494 -179.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 58.6 t80 -52.18 -47.52 65.5 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.493 179.8 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.552 ' CG ' ' H ' ' A' ' 92' ' ' THR . 43.4 t0 -155.4 -177.42 6.54 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.387 -179.799 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . 0.552 ' H ' ' CG ' ' A' ' 91' ' ' ASP . 5.5 t -77.48 6.84 6.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.451 -179.808 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . 0.552 ' CG ' ' CE1' ' B' ' 223' ' ' HIS . 34.9 m80 -62.27 -73.39 0.11 Allowed 'General case' 0 C--O 1.236 0.345 0 CA-C-O 120.976 0.417 . . . . 0.0 110.308 179.889 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 82.4 t -45.22 -40.19 2.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.29 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.46 -39.61 93.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.524 179.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 8.8 tp-100 -60.54 -47.43 86.2 Favored 'General case' 0 C--O 1.241 0.632 0 CA-C-O 121.095 0.474 . . . . 0.0 110.176 -179.412 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.649 HD21 ' HA ' ' B' ' 220' ' ' ALA . 7.2 mp -62.86 -43.28 99.22 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.263 -179.626 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 7.0 tp -63.58 -39.7 95.07 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.029 179.828 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 47.4 t0 -56.48 -47.63 78.82 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.169 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.531 ' N ' ' OE1' ' A' ' 100' ' ' GLU . 0.3 OUTLIER -63.33 -51.56 65.45 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 120.639 -0.425 . . . . 0.0 110.279 179.678 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.665 ' HA ' HD21 ' B' ' 216' ' ' LEU . . . -56.48 -43.01 79.23 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.575 179.893 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 4.1 mm -61.45 -45.6 98.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 C-N-CA 120.512 -0.475 . . . . 0.0 110.502 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 85.1 t80 -61.85 -45.02 95.62 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.981 0.42 . . . . 0.0 110.449 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . 0.534 ' CE1' ' CG ' ' B' ' 212' ' ' HIS . 13.9 t60 -55.43 -45.24 76.78 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.601 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 35.3 t -76.07 -33.64 59.56 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.859 179.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 78.7 tt0 -58.88 -38.93 79.94 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.378 -179.471 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . 0.427 ' O ' ' O ' ' A' ' 108' ' ' LEU . 7.6 t60 -55.03 -71.62 0.08 Allowed 'General case' 0 CA--C 1.521 -0.168 0 C-N-CA 120.503 -0.479 . . . . 0.0 110.159 -179.289 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.518 ' N ' HD22 ' A' ' 108' ' ' LEU . 4.0 mm? -56.8 -110.21 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.062 -179.656 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . 0.453 ' O ' ' CG ' ' A' ' 109' ' ' HIS . 83.8 t60 37.44 41.11 0.24 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.841 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 1.8 pp -67.81 -36.46 80.44 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.259 -179.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 147.08 42.66 0.04 OUTLIER Glycine 0 CA--C 1.523 0.548 0 N-CA-C 110.985 -0.846 . . . . 0.0 110.985 -179.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.474 ' O ' HD12 ' A' ' 112' ' ' LEU . 0.3 OUTLIER -101.38 175.95 5.4 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 121.028 0.442 . . . . 0.0 110.242 -179.994 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 23.1 m -102.53 114.22 28.24 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.415 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -64.78 -37.46 87.68 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.551 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 7.6 ptm180 -149.86 135.05 18.06 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.159 0.504 . . . . 0.0 110.715 -179.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . 0.576 ' N ' ' CD ' ' A' ' 117' ' ' PRO . 0.0 OUTLIER 169.37 -46.16 0.0 OUTLIER Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.809 -179.806 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . 0.576 ' CD ' ' N ' ' A' ' 116' ' ' HIS . 31.9 Cg_exo -56.81 -47.47 23.23 Favored 'Trans proline' 0 C--N 1.311 -1.436 0 C-N-CA 122.522 2.148 . . . . 0.0 111.903 -178.456 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 43.3 t -63.07 -43.99 97.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.674 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -66.82 142.3 57.4 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.542 -179.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.708 0 CA-C-O 117.991 -1.45 . . . . 0.0 110.917 179.963 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.332 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 70.1 t60 -85.07 -4.87 59.31 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.779 0.323 . . . . 0.0 110.623 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 123' ' ' GLY . . . . . . . . . . . . . . . -77.26 1.95 63.22 Favored Glycine 0 CA--C 1.525 0.71 0 N-CA-C 110.945 -0.862 . . . . 0.0 110.945 -179.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 124' ' ' VAL . . . . . 0.415 HG23 ' N ' ' B' ' 125' ' ' GLU . 27.3 m -64.53 -38.41 82.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 120.906 0.384 . . . . 0.0 110.773 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 125' ' ' GLU . . . . . 0.415 ' N ' HG23 ' B' ' 124' ' ' VAL . 97.5 mt-10 -58.59 141.1 53.2 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.582 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -178.86 -115.37 0.46 Allowed Glycine 0 CA--C 1.525 0.699 0 N-CA-C 110.913 -0.875 . . . . 0.0 110.913 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 127' ' ' ARG . . . . . 0.557 ' NH2' ' NH1' ' B' ' 129' ' ' ARG . 85.3 mtp180 -79.19 -8.08 58.73 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.86 0.362 . . . . 0.0 110.573 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 128' ' ' ASN . . . . . . . . . . . . . 66.4 t30 57.92 41.45 24.53 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.494 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 129' ' ' ARG . . . . . 0.557 ' NH1' ' NH2' ' B' ' 127' ' ' ARG . 81.0 mtt180 -112.01 150.29 42.17 Favored Pre-proline 0 CA--C 1.531 0.223 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.538 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -67.91 154.73 72.15 Favored 'Trans proline' 0 N--CA 1.492 1.401 0 C-N-CA 122.646 2.23 . . . . 0.0 111.903 179.622 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 63.8 p -143.93 86.21 1.85 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.501 179.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 132' ' ' ALA . . . . . . . . . . . . . . . -169.04 65.11 0.58 Allowed Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.41 179.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 133' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -74.9 113.75 3.87 Favored 'Trans proline' 0 N--CA 1.493 1.469 0 C-N-CA 122.606 2.204 . . . . 0.0 112.042 -179.688 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . 0.546 ' O ' ' N ' ' B' ' 136' ' ' SER . 38.9 mt -77.03 -144.67 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.311 -179.859 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 97.0 m-20 -42.58 -17.51 0.01 OUTLIER 'General case' 0 C--O 1.224 -0.28 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.746 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . 0.546 ' N ' ' O ' ' B' ' 134' ' ' LEU . 27.3 t -39.32 -49.89 1.99 Allowed 'General case' 0 C--O 1.238 0.49 0 CA-C-O 121.439 0.637 . . . . 0.0 110.479 -179.655 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -64.23 -45.99 85.8 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.902 179.352 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 138' ' ' ALA . . . . . 0.608 ' O ' HG23 ' B' ' 142' ' ' VAL . . . -58.74 -28.27 65.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.419 -179.878 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 139' ' ' ALA . . . . . 0.461 ' HB1' ' HB3' ' A' ' 36' ' ' LEU . . . -71.39 -50.74 29.02 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-O 120.85 0.357 . . . . 0.0 110.168 179.865 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -62.78 -40.95 98.91 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.522 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 4.7 tm0? -61.68 -51.19 69.46 Favored 'General case' 0 C--O 1.24 0.586 0 CA-C-O 121.395 0.617 . . . . 0.0 110.457 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 142' ' ' VAL . . . . . 0.608 HG23 ' O ' ' B' ' 138' ' ' ALA . 85.8 t -61.32 -44.33 98.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.013 179.844 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -56.38 -41.34 76.07 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 62.1 m -59.32 -45.36 91.53 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.178 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 46.9 p -64.0 -44.87 91.34 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.311 179.434 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 96.0 mt -66.4 -22.41 66.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.425 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 147' ' ' GLN . . . . . 0.525 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 59.5 tt0 -74.12 -59.08 2.89 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.29 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -60.78 -55.01 38.18 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 120.571 -0.452 . . . . 0.0 110.308 -179.632 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.475 ' O ' ' O ' ' B' ' 150' ' ' ALA . 47.8 tp -44.31 -31.3 0.99 Allowed 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 120.914 -0.314 . . . . 0.0 110.212 -178.684 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 150' ' ' ALA . . . . . 0.525 ' HB3' ' O ' ' B' ' 147' ' ' GLN . . . -59.16 -135.93 0.0 OUTLIER 'General case' 0 C--O 1.219 -0.524 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.614 179.07 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 151' ' ' THR . . . . . 0.454 ' O ' ' O ' ' B' ' 150' ' ' ALA . 10.1 m 53.97 113.31 0.01 OUTLIER Pre-proline 0 CA--C 1.538 0.505 0 CA-C-N 116.574 -0.284 . . . . 0.0 110.67 179.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -48.68 -46.89 22.63 Favored 'Trans proline' 0 C--N 1.309 -1.503 0 C-N-CA 122.169 1.913 . . . . 0.0 113.209 -178.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 66.8 m -52.91 -38.77 62.18 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.541 0.686 . . . . 0.0 111.052 -179.359 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 154' ' ' ARG . . . . . 0.4 HH11 ' HD3' ' B' ' 154' ' ' ARG . 3.5 mmp_? -71.75 -35.15 70.02 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.993 179.581 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 155' ' ' LEU . . . . . 0.464 ' HB3' ' HB1' ' A' ' 20' ' ' ALA . 3.8 mm? -64.16 -55.77 19.46 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.43 -0.508 . . . . 0.0 111.603 -179.046 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 156' ' ' MET . . . . . 0.432 ' O ' ' OG1' ' B' ' 159' ' ' THR . 0.1 OUTLIER -56.73 -46.26 81.42 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 179.677 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 97.4 mt -62.82 -43.04 98.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 C-N-CA 120.199 -0.6 . . . . 0.0 110.209 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 158' ' ' LEU . . . . . 0.477 HD11 HD21 ' B' ' 208' ' ' LEU . 58.4 tp -60.8 -42.59 97.93 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.287 -179.509 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 159' ' ' THR . . . . . 0.432 ' OG1' ' O ' ' B' ' 156' ' ' MET . 37.1 p -62.37 -35.37 78.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.112 -179.884 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 91.6 mm-40 -65.01 -50.75 65.04 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.965 0.412 . . . . 0.0 110.405 179.434 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 161' ' ' LEU . . . . . . . . . . . . . 82.2 mt -62.61 -32.64 73.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.72 179.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 162' ' ' ARG . . . . . . . . . . . . . 61.8 ttp180 -53.59 -39.04 64.52 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.33 -179.755 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 54.9 t-20 -61.19 -41.11 96.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.945 0.402 . . . . 0.0 110.405 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . 164.55 -176.7 40.38 Favored Glycine 0 CA--C 1.525 0.692 0 N-CA-C 111.12 -0.792 . . . . 0.0 111.12 179.433 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_exo -66.7 150.4 83.6 Favored 'Trans proline' 0 C--N 1.308 -1.6 0 C-N-CA 122.964 2.443 . . . . 0.0 111.937 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 1.7 pp -177.39 146.3 0.63 Allowed Pre-proline 0 N--CA 1.449 -0.509 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.573 178.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -74.53 174.99 11.66 Favored 'Trans proline' 0 N--CA 1.493 1.495 0 C-N-CA 122.873 2.382 . . . . 0.0 112.167 179.546 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . 3.6 m -71.42 -32.77 47.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 121.945 0.879 . . . . 0.0 110.808 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 169' ' ' THR . . . . . . . . . . . . . 50.4 p -58.16 -39.97 80.2 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-N 114.563 -1.199 . . . . 0.0 110.465 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 68.1 m-20 -68.53 -37.97 80.44 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.588 179.625 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 171' ' ' LEU . . . . . 0.627 ' O ' HD13 ' B' ' 171' ' ' LEU . 0.2 OUTLIER -63.76 -38.59 91.66 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.096 -179.365 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 172' ' ' ALA . . . . . 0.517 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -62.81 -46.64 87.01 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.661 179.85 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -56.12 -44.66 79.35 Favored 'General case' 0 C--O 1.232 0.151 0 C-N-CA 120.46 -0.496 . . . . 0.0 109.943 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -59.96 -50.32 74.21 Favored 'General case' 0 C--O 1.231 0.091 0 C-N-CA 120.664 -0.414 . . . . 0.0 110.438 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 97.1 mt -93.35 -78.24 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.187 179.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 176' ' ' GLY . . . . . 0.517 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 142.29 91.62 0.17 Allowed Glycine 0 CA--C 1.519 0.336 0 N-CA-C 111.441 -0.664 . . . . 0.0 111.441 179.779 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 32.7 ttp 66.83 107.6 0.04 OUTLIER 'General case' 0 CA--C 1.518 -0.268 0 CA-C-O 120.66 0.267 . . . . 0.0 110.905 179.169 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 178' ' ' GLU . . . . . 0.423 ' H ' ' H ' ' B' ' 179' ' ' GLN . 1.9 mt-10 174.63 12.43 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.618 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 179' ' ' GLN . . . . . 0.423 ' H ' ' H ' ' B' ' 178' ' ' GLU . 35.3 mt-30 -54.53 -38.14 66.22 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.61 -179.415 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 38.2 m -60.65 -48.29 82.43 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.855 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -57.08 -35.28 69.19 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.129 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 86.2 t -69.89 -53.37 24.31 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.774 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 77.6 p -57.14 -42.14 80.43 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.965 0.412 . . . . 0.0 110.572 -179.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 57.6 t-80 -63.92 -50.7 67.68 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-O 121.054 0.454 . . . . 0.0 110.794 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 85.6 mt-30 -62.3 -38.74 90.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.35 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 186' ' ' LEU . . . . . 0.451 HD21 ' CD1' ' B' ' 206' ' ' TYR . 58.1 tp -60.2 -45.14 94.18 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.219 -179.784 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 75.5 ttt180 -60.84 -44.45 96.95 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-O 121.135 0.493 . . . . 0.0 110.453 -179.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 88.9 t -66.74 -54.21 27.52 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.486 0 C-N-CA 120.121 -0.632 . . . . 0.0 110.709 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 97.7 mt -56.72 -41.32 77.25 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 -179.253 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 59.6 ttt85 -57.96 -39.97 79.42 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.237 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -61.19 -42.53 98.74 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 120.506 -0.478 . . . . 0.0 110.721 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 192' ' ' LEU . . . . . 0.495 HD23 ' N ' ' B' ' 192' ' ' LEU . 6.1 mt -66.96 -42.38 85.3 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.958 0.409 . . . . 0.0 110.5 -179.284 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 101.82 95.47 2.26 Favored Glycine 0 CA--C 1.524 0.647 0 N-CA-C 111.474 -0.65 . . . . 0.0 111.474 179.65 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 194' ' ' LEU . . . . . 0.413 ' H ' ' H ' ' B' ' 195' ' ' VAL . 0.5 OUTLIER -170.71 -7.93 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.924 0.393 . . . . 0.0 110.586 179.139 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 195' ' ' VAL . . . . . 0.413 ' H ' ' H ' ' B' ' 194' ' ' LEU . 22.4 m -136.79 156.11 34.45 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.08 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 196' ' ' VAL . . . . . 0.417 HG12 ' N ' ' B' ' 197' ' ' GLY . 66.5 t -143.53 155.34 16.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.39 -179.909 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 197' ' ' GLY . . . . . 0.417 ' N ' HG12 ' B' ' 196' ' ' VAL . . . -127.03 146.37 16.32 Favored Glycine 0 N--CA 1.463 0.484 0 N-CA-C 110.351 -1.099 . . . . 0.0 110.351 179.519 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 96.6 m-20 -103.32 116.37 32.3 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 120.606 0.241 . . . . 0.0 110.489 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 61.4 ttp180 -95.52 135.69 36.85 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.168 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 200' ' ' ALA . . . . . . . . . . . . . . . -145.4 94.79 2.56 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.503 -179.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 201' ' ' GLY . . . . . . . . . . . . . . . 61.8 -90.12 0.05 OUTLIER Glycine 0 CA--C 1.523 0.558 0 N-CA-C 110.629 -0.988 . . . . 0.0 110.629 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 202' ' ' ARG . . . . . . . . . . . . . 83.7 mtp180 -125.45 13.98 8.2 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.639 0.257 . . . . 0.0 110.66 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 43.1 m -119.93 111.67 18.22 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-O 120.926 0.393 . . . . 0.0 110.382 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 2.4 tp -120.21 130.2 74.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.948 179.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 23.5 m -122.01 158.86 25.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.429 178.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 206' ' ' TYR . . . . . 0.451 ' CD1' HD21 ' B' ' 186' ' ' LEU . 40.5 m-85 -114.22 137.63 51.53 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.646 -179.51 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 14.9 m -151.75 172.0 16.82 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.343 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 208' ' ' LEU . . . . . 0.615 ' N ' HD12 ' B' ' 208' ' ' LEU . 8.4 mp -75.79 148.11 38.7 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.555 179.763 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 67.5 t80 -52.71 -46.71 67.45 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.358 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 210' ' ' ASP . . . . . 0.518 ' CG ' ' H ' ' B' ' 211' ' ' THR . 43.5 t0 -157.01 -177.4 6.59 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.807 0.337 . . . . 0.0 110.505 -179.827 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 211' ' ' THR . . . . . 0.518 ' H ' ' CG ' ' B' ' 210' ' ' ASP . 4.8 t -77.09 4.77 9.48 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.483 -179.861 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 212' ' ' HIS . . . . . 0.534 ' CG ' ' CE1' ' A' ' 104' ' ' HIS . 35.1 m80 -60.35 -74.72 0.07 Allowed 'General case' 0 C--O 1.237 0.395 0 CA-C-O 121.016 0.436 . . . . 0.0 110.327 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 71.3 t -44.5 -39.82 1.78 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.352 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 214' ' ' ALA . . . . . . . . . . . . . . . -63.26 -39.4 94.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.501 179.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 215' ' ' GLN . . . . . 0.4 ' N ' ' O ' ' B' ' 212' ' ' HIS . 8.8 tp-100 -59.87 -47.51 85.44 Favored 'General case' 0 C--O 1.24 0.559 0 CA-C-O 121.146 0.498 . . . . 0.0 110.013 -179.521 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 216' ' ' LEU . . . . . 0.665 HD21 ' HA ' ' A' ' 101' ' ' ALA . 7.3 mp -62.75 -42.62 99.76 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.146 -179.548 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 6.5 tp -63.73 -38.74 92.23 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.085 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 64.0 t0 -57.81 -46.19 85.03 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.928 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 219' ' ' GLU . . . . . 0.527 ' OE1' ' N ' ' B' ' 219' ' ' GLU . 0.3 OUTLIER -64.76 -50.72 65.73 Favored 'General case' 0 N--CA 1.462 0.163 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.37 179.631 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 220' ' ' ALA . . . . . 0.649 ' HA ' HD21 ' A' ' 97' ' ' LEU . . . -57.75 -42.79 84.66 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 120.876 0.369 . . . . 0.0 110.565 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 4.1 mm -62.07 -44.36 98.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.6 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 80.2 t80 -62.22 -44.55 96.32 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.965 0.412 . . . . 0.0 110.324 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 223' ' ' HIS . . . . . 0.552 ' CE1' ' CG ' ' A' ' 93' ' ' HIS . 13.2 t60 -56.29 -44.9 80.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.675 -179.799 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 27.2 t -75.55 -36.34 60.47 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.939 179.669 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 80.3 tt0 -56.81 -37.93 71.88 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.308 -179.399 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 226' ' ' HIS . . . . . 0.425 ' O ' ' O ' ' B' ' 227' ' ' LEU . 9.1 t60 -56.01 -71.81 0.08 Allowed 'General case' 0 C--N 1.332 -0.175 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.094 -179.467 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 227' ' ' LEU . . . . . 0.536 HD22 ' N ' ' B' ' 227' ' ' LEU . 4.1 mm? -56.88 -109.55 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.03 -179.634 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 228' ' ' HIS . . . . . 0.469 ' CG ' ' O ' ' B' ' 228' ' ' HIS . 82.9 t60 36.74 41.19 0.16 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.721 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 229' ' ' LEU . . . . . . . . . . . . . 1.8 pp -67.65 -34.39 76.85 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.534 -179.771 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . 145.3 41.06 0.05 OUTLIER Glycine 0 CA--C 1.523 0.533 0 N-CA-C 111.121 -0.792 . . . . 0.0 111.121 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 231' ' ' LEU . . . . . 0.451 ' C ' HD12 ' B' ' 231' ' ' LEU . 0.3 OUTLIER -99.81 -179.78 4.28 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 -179.985 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 232' ' ' SER . . . . . . . . . . . . . 70.4 m -110.12 114.37 27.81 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.469 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 233' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -64.49 -40.19 95.21 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.459 179.7 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 234' ' ' ARG . . . . . . . . . . . . . 7.9 ptm180 -142.38 136.89 30.04 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.113 0.482 . . . . 0.0 110.453 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 235' ' ' HIS . . . . . 0.57 ' N ' ' HD2' ' B' ' 236' ' ' PRO . 0.1 OUTLIER 170.06 -59.17 0.0 OUTLIER Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.013 -178.926 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 236' ' ' PRO . . . . . 0.57 ' HD2' ' N ' ' B' ' 235' ' ' HIS . 13.9 Cg_endo -55.26 -42.09 72.0 Favored 'Trans proline' 0 C--N 1.311 -1.42 0 C-N-CA 122.579 2.186 . . . . 0.0 111.818 -178.521 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 237' ' ' SER . . . . . . . . . . . . . 11.5 t -62.17 -44.55 96.36 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.467 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 238' ' ' ALA . . . . . . . . . . . . . . . -70.99 144.6 50.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.467 179.824 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.218 -0.849 0 CA-C-O 117.99 -1.45 . . . . 0.0 110.968 -179.965 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.219 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 4.6 p80 -151.91 162.06 41.66 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.911 0.386 . . . . 0.0 110.557 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 56.18 102.04 0.01 OUTLIER Glycine 0 CA--C 1.524 0.65 0 N-CA-C 110.932 -0.867 . . . . 0.0 110.932 -180.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 11.9 p -62.37 -32.67 55.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.995 0.426 . . . . 0.0 110.71 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -61.32 -174.61 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.686 179.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -173.95 176.1 46.45 Favored Glycine 0 CA--C 1.524 0.599 0 N-CA-C 111.006 -0.838 . . . . 0.0 111.006 -179.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 89.0 mtm180 -79.83 57.89 2.69 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.757 0.313 . . . . 0.0 110.43 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 95.3 m-20 -62.52 -41.78 99.07 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.383 -179.837 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.896 ' H ' ' HE ' ' A' ' 10' ' ' ARG . 2.3 mmp_? 40.43 59.21 7.65 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.665 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -71.21 16.72 0.29 Allowed 'Trans proline' 0 C--N 1.306 -1.665 0 C-N-CA 122.717 2.278 . . . . 0.0 112.043 -179.444 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.441 ' H ' ' C ' ' A' ' 10' ' ' ARG . 73.9 p -119.0 7.02 11.33 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.822 -179.813 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.624 ' N ' ' CD ' ' A' ' 14' ' ' PRO . . . -73.6 -42.14 6.25 Favored Pre-proline 0 C--N 1.323 -0.567 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.684 179.325 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.624 ' CD ' ' N ' ' A' ' 13' ' ' ALA . 31.4 Cg_exo -57.84 141.91 96.05 Favored 'Trans proline' 0 C--N 1.312 -1.348 0 C-N-CA 122.61 2.207 . . . . 0.0 111.703 -179.057 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.523 ' O ' ' N ' ' A' ' 17' ' ' SER . 0.1 OUTLIER -107.26 -71.26 0.76 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.26 -179.93 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.429 ' C ' ' O ' ' A' ' 15' ' ' LEU . 97.2 m-20 -34.59 -31.28 0.01 OUTLIER 'General case' 0 C--N 1.339 0.151 0 O-C-N 123.469 0.481 . . . . 0.0 110.599 -179.25 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.523 ' N ' ' O ' ' A' ' 15' ' ' LEU . 88.7 p -44.09 -50.05 8.63 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 121.334 0.588 . . . . 0.0 110.066 179.216 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -63.91 -44.46 92.87 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.191 179.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.486 ' O ' HG23 ' A' ' 23' ' ' VAL . . . -57.39 -29.51 64.14 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.407 179.785 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -72.96 -50.58 22.51 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 120.885 0.374 . . . . 0.0 110.205 179.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.75 -41.98 95.5 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.912 179.731 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 72.6 tp60 -64.64 -52.94 54.73 Favored 'General case' 0 C--O 1.242 0.664 0 CA-C-O 121.255 0.55 . . . . 0.0 110.622 -179.399 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.486 HG23 ' O ' ' A' ' 19' ' ' ALA . 93.0 t -63.17 -45.94 97.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.994 -179.808 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -53.43 -43.17 67.8 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.195 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 49.2 m -59.9 -44.15 94.43 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.799 0.333 . . . . 0.0 110.47 179.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 95.6 m -63.8 -51.0 66.75 Favored 'General case' 0 C--O 1.238 0.478 0 C-N-CA 120.619 -0.432 . . . . 0.0 110.835 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.431 ' N ' ' CD1' ' A' ' 27' ' ' LEU . 7.8 mp -66.94 -19.77 65.78 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.703 179.77 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.475 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 55.8 tt0 -74.82 -59.91 2.52 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.636 179.4 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -57.12 -52.15 66.46 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.445 -179.566 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 97.0 mt -54.81 -39.75 68.81 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.226 -179.173 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.561 ' O ' ' C ' ' A' ' 32' ' ' THR . . . -40.25 -73.33 0.05 OUTLIER 'General case' 0 CA--C 1.514 -0.442 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.299 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.561 ' C ' ' O ' ' A' ' 31' ' ' ALA . 94.9 m -2.98 107.08 0.03 OUTLIER Pre-proline 0 CA--C 1.539 0.533 0 O-C-N 124.556 1.16 . . . . 0.0 111.098 -179.339 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -44.19 -50.37 7.79 Favored 'Trans proline' 0 C--N 1.308 -1.577 0 C-N-CA 122.289 1.993 . . . . 0.0 113.039 -177.378 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 10.0 t -58.39 -46.78 85.7 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.034 -179.527 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.437 ' HA ' HE22 ' A' ' 66' ' ' GLN . 50.6 ttm-85 -64.09 -43.66 94.73 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.388 -179.505 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.563 HD23 ' O ' ' A' ' 36' ' ' LEU . 2.1 tt -61.09 -52.26 65.66 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.468 -0.493 . . . . 0.0 110.545 -178.915 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 49.0 ttp -53.87 -47.0 71.48 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.737 -0.385 . . . . 0.0 110.754 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.498 HG21 ' OE1' ' A' ' 66' ' ' GLN . 88.1 mt -60.81 -47.71 92.04 Favored 'Isoleucine or valine' 0 C--O 1.239 0.534 0 CA-C-O 121.36 0.6 . . . . 0.0 110.687 -179.254 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -62.56 -41.06 98.68 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.691 179.682 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 75.4 m -59.21 -40.53 86.09 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.861 179.799 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 53.6 tp60 -61.55 -44.99 96.04 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.311 -0.404 . . . . 0.0 109.989 -179.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.443 ' O ' ' N ' ' A' ' 44' ' ' ASN . 9.7 mt -66.83 -24.29 66.14 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.971 179.634 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.432 ' C ' ' O ' ' A' ' 42' ' ' LEU . 72.1 ttp85 -33.78 -35.71 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 O-C-N 123.578 0.549 . . . . 0.0 111.063 -179.347 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.708 ' HB3' HD11 ' A' ' 47' ' ' LEU . 58.0 t-20 -62.2 -72.92 0.11 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.212 179.26 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.503 ' H ' ' CD1' ' A' ' 47' ' ' LEU . . . 153.74 -75.07 0.24 Allowed Glycine 0 CA--C 1.526 0.778 0 N-CA-C 111.206 -0.758 . . . . 0.0 111.206 179.515 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.773 ' C ' HD12 ' A' ' 47' ' ' LEU . 71.6 Cg_endo -81.19 98.53 1.03 Allowed 'Trans proline' 0 C--N 1.312 -1.377 0 C-N-CA 122.655 2.237 . . . . 0.0 112.349 179.108 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.773 HD12 ' C ' ' A' ' 46' ' ' PRO . 5.1 mp -145.61 69.4 13.62 Favored Pre-proline 0 N--CA 1.465 0.28 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.236 179.475 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_exo -45.81 163.89 0.08 OUTLIER 'Trans proline' 0 C--N 1.308 -1.575 0 C-N-CA 122.563 2.175 . . . . 0.0 112.038 179.681 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 91.5 t -54.4 -47.07 70.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 121.129 0.49 . . . . 0.0 110.373 -178.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 66.4 p -63.98 -34.81 78.83 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.454 179.301 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -67.62 -39.94 84.68 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.807 179.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 16.5 mt -62.89 -40.01 96.22 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.925 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.569 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -59.67 -48.1 83.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.982 -0.554 . . . . 0.0 109.533 179.384 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 42.6 tp10 -56.91 -46.04 82.23 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.549 -0.46 . . . . 0.0 109.991 179.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -63.38 -51.21 66.8 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 120.73 -0.388 . . . . 0.0 110.662 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 97.5 mt -81.28 -71.0 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.519 -180.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . 0.569 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 130.53 75.01 0.14 Allowed Glycine 0 N--CA 1.463 0.449 0 N-CA-C 111.206 -0.757 . . . . 0.0 111.206 179.546 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 8.8 ttp 73.87 103.07 0.07 Allowed 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 120.993 -0.283 . . . . 0.0 110.848 179.343 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 179.89 17.68 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.383 179.608 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.411 ' HG3' ' H ' ' A' ' 60' ' ' GLN . 9.2 mt-30 -51.75 -32.09 29.21 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.8 -179.349 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 50.9 m -66.8 -43.56 83.59 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.91 179.845 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.87 -30.66 71.73 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.252 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 75.1 t -72.78 -52.84 20.94 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.235 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.579 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 69.4 m -56.35 -45.33 80.48 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.416 -179.292 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 62.9 m-70 -62.87 -49.73 73.68 Favored 'General case' 0 C--O 1.239 0.501 0 CA-C-O 121.214 0.531 . . . . 0.0 111.004 179.786 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.498 ' OE1' HG21 ' A' ' 38' ' ' ILE . 51.2 tt0 -62.49 -38.73 91.01 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.233 -179.742 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 4.5 tt -61.57 -43.34 99.04 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.646 -179.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -61.69 -42.02 98.37 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.934 -0.306 . . . . 0.0 110.616 179.77 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 89.2 t -64.48 -55.04 23.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 C-N-CA 120.135 -0.626 . . . . 0.0 110.678 -179.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 10.8 mp -61.73 -41.04 97.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.961 0.41 . . . . 0.0 110.132 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 79.0 ttt-85 -56.19 -41.72 76.01 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.094 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 8.2 t-20 -58.25 -49.89 75.51 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.6 -0.44 . . . . 0.0 110.228 -179.563 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.546 HD22 ' N ' ' A' ' 73' ' ' LEU . 4.0 mm? -68.09 -41.64 81.55 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.816 179.29 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 105.12 43.24 1.66 Allowed Glycine 0 CA--C 1.524 0.648 0 N-CA-C 111.076 -0.81 . . . . 0.0 111.076 -179.776 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.489 ' N ' HD12 ' A' ' 75' ' ' LEU . 9.0 mp -97.4 -15.22 20.77 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 110.448 -0.204 . . . . 0.0 110.448 179.378 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 30.5 m -136.83 160.22 36.95 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.344 0 CA-C-O 120.801 0.334 . . . . 0.0 110.334 -179.85 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.422 HG12 ' N ' ' A' ' 78' ' ' GLY . 51.5 t -140.16 155.48 23.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.356 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.422 ' N ' HG12 ' A' ' 77' ' ' VAL . . . -126.66 149.67 17.64 Favored Glycine 0 CA--C 1.521 0.431 0 N-CA-C 110.515 -1.034 . . . . 0.0 110.515 179.612 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -113.64 107.87 16.36 Favored 'General case' 0 C--O 1.236 0.388 0 N-CA-C 110.256 -0.276 . . . . 0.0 110.256 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 15.1 tpt180 -73.5 132.05 42.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.595 -179.674 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -145.83 94.61 2.51 Favored 'General case' 0 CA--C 1.522 -0.119 0 CA-C-O 120.784 0.326 . . . . 0.0 110.328 179.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 58.32 -118.46 13.55 Favored Glycine 0 CA--C 1.522 0.491 0 N-CA-C 110.839 -0.904 . . . . 0.0 110.839 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 84.2 mtt85 -98.8 17.31 19.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.614 0.245 . . . . 0.0 110.725 179.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 2.5 t -139.66 142.82 36.95 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-O 120.942 0.401 . . . . 0.0 110.554 -179.606 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.447 ' CD1' ' CE1' ' A' ' 87' ' ' TYR . 0.0 OUTLIER -138.79 145.2 28.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.501 179.748 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 77.3 t -114.13 134.45 56.97 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.653 -179.651 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.447 ' CE1' ' CD1' ' A' ' 85' ' ' ILE . 84.2 m-85 -99.51 130.02 45.72 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.198 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 31.3 p -146.01 165.77 28.03 Favored 'General case' 0 C--O 1.224 -0.263 0 N-CA-C 109.816 -0.439 . . . . 0.0 109.816 -179.379 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.624 ' N ' HD12 ' A' ' 89' ' ' LEU . 8.0 mp -67.53 147.5 52.72 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.369 -179.416 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 61.3 t80 -50.55 -42.38 55.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.426 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 46.8 p30 -146.71 179.68 7.4 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.508 -0.315 . . . . 0.0 110.4 -179.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . 0.595 ' O ' ' HB3' ' A' ' 95' ' ' ALA . 28.1 m -95.27 -17.65 21.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.499 -179.898 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 92.2 m-70 -40.97 -66.1 0.36 Allowed 'General case' 0 C--O 1.235 0.322 0 CA-C-O 121.368 0.604 . . . . 0.0 110.964 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 8.3 p -47.5 -34.89 3.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.347 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.595 ' HB3' ' O ' ' A' ' 92' ' ' THR . . . -64.08 -39.75 94.73 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.303 179.569 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -59.47 -45.43 91.66 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.919 -179.773 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.697 HD21 ' HA ' ' B' ' 220' ' ' ALA . 8.3 mp -60.74 -44.15 97.03 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.336 -0.546 . . . . 0.0 109.875 -179.315 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.558 HD11 HD21 ' A' ' 36' ' ' LEU . 6.1 tp -64.8 -38.33 90.62 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.526 179.521 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 63.9 t0 -57.05 -46.57 82.32 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.984 -179.487 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -70.32 -47.86 59.2 Favored 'General case' 0 C--O 1.232 0.152 0 C-N-CA 120.566 -0.454 . . . . 0.0 110.105 179.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.679 ' HA ' HD21 ' B' ' 216' ' ' LEU . . . -53.46 -47.87 69.35 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.461 179.602 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 4.3 mm -63.09 -44.59 99.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 C-N-CA 120.626 -0.43 . . . . 0.0 110.64 -179.511 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 86.5 t80 -60.37 -41.42 93.68 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.018 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . 0.521 ' CE1' HD12 ' A' ' 108' ' ' LEU . 64.7 t60 -69.28 -39.85 78.1 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.716 179.61 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.489 ' O ' ' N ' ' A' ' 109' ' ' HIS . 48.3 t -57.86 -47.82 81.59 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.544 -178.965 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.479 ' C ' ' N ' ' A' ' 108' ' ' LEU . 98.3 mt-10 -76.89 -54.45 6.58 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.94 0.4 . . . . 0.0 111.411 179.212 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 83.6 t60 -48.75 -13.11 0.05 OUTLIER 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.268 -178.762 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.521 HD12 ' CE1' ' A' ' 104' ' ' HIS . 64.2 mt -142.92 -74.39 0.28 Allowed 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.801 179.737 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . 0.489 ' N ' ' O ' ' A' ' 105' ' ' SER . 15.2 t-80 78.37 74.67 0.06 Allowed 'General case' 0 C--N 1.33 -0.264 0 O-C-N 123.45 0.469 . . . . 0.0 110.488 -179.827 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.621 ' N ' HD12 ' A' ' 110' ' ' LEU . 9.6 mp -63.08 -42.82 99.72 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.888 0.375 . . . . 0.0 110.27 -179.543 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 69.01 129.03 0.05 OUTLIER Glycine 0 CA--C 1.524 0.636 0 N-CA-C 111.159 -0.777 . . . . 0.0 111.159 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 2.2 pp -156.96 141.32 16.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.9 0.381 . . . . 0.0 110.522 179.739 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 25.8 t -164.04 41.59 0.09 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.456 -179.839 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 52.9 p-10 -82.38 169.79 16.05 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.472 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 88.8 mtm180 -75.46 149.66 38.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.651 -179.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 69.0 m-70 -45.18 150.45 0.79 Allowed Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.628 -179.544 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -66.34 -24.15 50.67 Favored 'Trans proline' 0 N--CA 1.495 1.57 0 C-N-CA 122.611 2.207 . . . . 0.0 112.096 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 48.5 t 47.25 -107.21 0.17 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.584 -179.646 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . 49.28 -161.37 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.586 -179.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.766 0 CA-C-O 118.063 -1.409 . . . . 0.0 110.922 179.965 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.272 0 N-CA-C 109.505 -1.438 . . . . 0.0 109.505 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 4.6 p80 -151.56 160.63 43.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.842 0.353 . . . . 0.0 110.54 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 123' ' ' GLY . . . . . . . . . . . . . . . 57.01 101.62 0.01 OUTLIER Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.986 -0.846 . . . . 0.0 110.986 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 12.2 p -62.04 -32.49 54.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.024 0.44 . . . . 0.0 110.716 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 125' ' ' GLU . . . . . . . . . . . . . 94.8 mt-10 -60.53 -171.7 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.798 179.72 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -176.93 178.14 48.16 Favored Glycine 0 CA--C 1.523 0.586 0 N-CA-C 110.975 -0.85 . . . . 0.0 110.975 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 127' ' ' ARG . . . . . . . . . . . . . 89.6 mtm180 -82.21 58.06 3.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.823 0.344 . . . . 0.0 110.571 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 128' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 -62.7 -42.32 99.58 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.573 -179.88 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 129' ' ' ARG . . . . . 0.866 ' H ' ' HE ' ' B' ' 129' ' ' ARG . 2.8 mmp_? 41.07 59.43 8.4 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.607 179.93 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -71.37 14.81 0.36 Allowed 'Trans proline' 0 C--N 1.308 -1.58 0 C-N-CA 122.661 2.241 . . . . 0.0 112.123 -179.589 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 131' ' ' SER . . . . . 0.417 ' H ' ' C ' ' B' ' 129' ' ' ARG . 83.2 p -116.71 5.62 13.18 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.883 -179.832 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 132' ' ' ALA . . . . . 0.619 ' N ' ' CD ' ' B' ' 133' ' ' PRO . . . -72.79 -41.86 7.39 Favored Pre-proline 0 C--N 1.322 -0.624 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.575 179.255 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 133' ' ' PRO . . . . . 0.619 ' CD ' ' N ' ' B' ' 132' ' ' ALA . 32.0 Cg_exo -57.44 140.76 94.15 Favored 'Trans proline' 0 C--N 1.311 -1.436 0 C-N-CA 122.678 2.252 . . . . 0.0 111.631 -179.046 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . 0.511 ' O ' ' N ' ' B' ' 136' ' ' SER . 0.1 OUTLIER -106.46 -71.53 0.75 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.072 -179.997 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 135' ' ' ASP . . . . . 0.43 ' C ' ' O ' ' B' ' 134' ' ' LEU . 98.0 m-20 -34.68 -30.94 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.19 0 O-C-N 123.48 0.488 . . . . 0.0 110.591 -179.231 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . 0.511 ' N ' ' O ' ' B' ' 134' ' ' LEU . 83.4 p -44.51 -50.89 9.28 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.231 179.303 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -63.48 -44.01 95.65 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.235 179.861 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 138' ' ' ALA . . . . . 0.428 ' O ' HG23 ' B' ' 142' ' ' VAL . . . -57.73 -29.35 64.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.383 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -72.62 -50.33 26.02 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 121.106 0.479 . . . . 0.0 110.222 179.497 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -65.01 -40.94 95.64 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.724 179.67 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 66.1 tp60 -65.19 -53.59 42.35 Favored 'General case' 0 C--O 1.241 0.62 0 CA-C-O 121.272 0.558 . . . . 0.0 110.761 -179.298 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 142' ' ' VAL . . . . . 0.428 HG23 ' O ' ' B' ' 138' ' ' ALA . 92.6 t -62.97 -46.47 96.24 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.881 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -52.25 -43.67 64.48 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.229 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 51.0 m -59.88 -44.2 94.32 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.4 179.797 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 22.8 m -63.08 -51.76 65.37 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 120.493 -0.483 . . . . 0.0 111.065 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 146' ' ' LEU . . . . . 0.453 ' N ' ' CD1' ' B' ' 146' ' ' LEU . 7.7 mp -66.82 -19.79 65.81 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.667 179.761 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 147' ' ' GLN . . . . . 0.445 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 57.8 tt0 -74.38 -61.01 2.01 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.62 179.548 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -56.58 -51.63 67.9 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.631 -179.524 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.403 ' O ' ' C ' ' B' ' 150' ' ' ALA . 97.1 mt -55.2 -39.97 70.24 Favored 'General case' 0 CA--C 1.515 -0.386 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.307 -179.105 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 150' ' ' ALA . . . . . 0.558 ' O ' ' C ' ' B' ' 151' ' ' THR . . . -40.18 -73.94 0.04 OUTLIER 'General case' 0 CA--C 1.513 -0.464 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.262 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 151' ' ' THR . . . . . 0.558 ' C ' ' O ' ' B' ' 150' ' ' ALA . 92.4 m -2.24 106.87 0.03 OUTLIER Pre-proline 0 CA--C 1.539 0.528 0 O-C-N 124.627 1.204 . . . . 0.0 110.994 -179.333 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -43.72 -50.54 7.04 Favored 'Trans proline' 0 C--N 1.307 -1.638 0 C-N-CA 122.231 1.954 . . . . 0.0 112.977 -177.169 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 11.1 t -58.56 -46.32 87.13 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.985 -179.344 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 50.6 ttm-85 -63.68 -44.65 93.1 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 120.708 -0.397 . . . . 0.0 110.526 -179.497 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 155' ' ' LEU . . . . . 0.611 HD21 HD11 ' B' ' 217' ' ' LEU . 1.6 tt -60.88 -51.41 69.42 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.543 -0.463 . . . . 0.0 110.464 -178.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 50.4 ttp -54.07 -47.53 71.59 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.583 -0.447 . . . . 0.0 110.942 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 157' ' ' ILE . . . . . 0.491 HG21 ' OE1' ' B' ' 185' ' ' GLN . 90.5 mt -61.1 -47.51 93.24 Favored 'Isoleucine or valine' 0 C--O 1.239 0.526 0 CA-C-O 121.228 0.537 . . . . 0.0 110.58 -179.326 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -62.51 -41.16 98.66 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.654 179.467 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 159' ' ' THR . . . . . 0.435 ' OG1' ' CD2' ' B' ' 155' ' ' LEU . 18.6 m -59.37 -40.11 85.43 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.813 179.718 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 56.4 tp60 -61.6 -45.23 94.98 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.061 0.458 . . . . 0.0 109.921 -179.71 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 161' ' ' LEU . . . . . 0.438 ' O ' ' N ' ' B' ' 163' ' ' ASN . 9.5 mt -66.39 -23.84 66.39 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.96 179.702 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 162' ' ' ARG . . . . . 0.436 ' C ' ' O ' ' B' ' 161' ' ' LEU . 72.1 ttp85 -34.05 -35.54 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 O-C-N 123.533 0.521 . . . . 0.0 111.114 -179.214 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 163' ' ' ASN . . . . . 0.676 ' HB3' HD11 ' B' ' 166' ' ' LEU . 58.8 t-20 -61.77 -71.41 0.15 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.26 179.382 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 164' ' ' GLY . . . . . 0.479 ' H ' ' CD1' ' B' ' 166' ' ' LEU . . . 153.36 -76.33 0.22 Allowed Glycine 0 CA--C 1.527 0.822 0 N-CA-C 111.157 -0.777 . . . . 0.0 111.157 179.545 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 165' ' ' PRO . . . . . 0.792 ' C ' HD12 ' B' ' 166' ' ' LEU . 74.3 Cg_endo -82.08 101.74 1.16 Allowed 'Trans proline' 0 N--CA 1.492 1.391 0 C-N-CA 122.605 2.203 . . . . 0.0 112.182 179.174 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 166' ' ' LEU . . . . . 0.792 HD12 ' C ' ' B' ' 165' ' ' PRO . 5.3 mp -146.61 69.76 12.44 Favored Pre-proline 0 N--CA 1.464 0.246 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.397 179.666 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_exo -45.57 163.09 0.09 OUTLIER 'Trans proline' 0 C--N 1.307 -1.614 0 C-N-CA 122.52 2.147 . . . . 0.0 112.049 179.431 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . 87.6 t -53.85 -46.79 64.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 121.099 0.476 . . . . 0.0 110.402 -179.195 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 169' ' ' THR . . . . . . . . . . . . . 64.2 p -63.94 -35.46 80.74 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.472 179.374 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -66.79 -40.14 88.02 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.095 179.621 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 16.5 mt -63.12 -40.55 97.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.137 179.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 172' ' ' ALA . . . . . 0.577 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -59.06 -47.86 83.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.487 179.48 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 42.3 tp10 -57.02 -45.93 82.74 Favored 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 120.46 -0.496 . . . . 0.0 110.029 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -63.31 -49.72 72.89 Favored 'General case' 0 C--O 1.231 0.103 0 C-N-CA 120.669 -0.412 . . . . 0.0 110.717 -179.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 96.3 mt -82.62 -71.16 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.432 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 176' ' ' GLY . . . . . 0.577 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 129.8 74.25 0.14 Allowed Glycine 0 N--CA 1.463 0.476 0 N-CA-C 111.205 -0.758 . . . . 0.0 111.205 179.419 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 177' ' ' MET . . . . . 0.421 ' CB ' ' O ' ' B' ' 176' ' ' GLY . 3.4 tmm? 75.43 102.08 0.07 Allowed 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 120.668 -0.413 . . . . 0.0 110.879 179.407 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 179.26 18.08 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.335 179.679 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 12.1 mt-30 -52.5 -32.01 38.1 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.651 -179.299 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 47.0 m -66.4 -43.44 85.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.921 0.391 . . . . 0.0 110.903 179.72 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -63.92 -30.77 71.83 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.365 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 94.5 t -72.78 -52.86 20.83 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.244 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.777 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 74.3 m -56.49 -45.49 80.95 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.456 -179.48 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 58.6 m-70 -62.22 -48.91 77.89 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.111 0.481 . . . . 0.0 110.661 179.789 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 185' ' ' GLN . . . . . 0.491 ' OE1' HG21 ' B' ' 157' ' ' ILE . 50.6 tt0 -62.9 -39.72 95.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.262 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 5.4 tt -61.05 -43.31 99.07 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.559 -179.722 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -61.81 -42.36 98.92 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 120.979 -0.288 . . . . 0.0 110.687 179.712 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 99.4 t -64.18 -54.89 25.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 C-N-CA 120.158 -0.617 . . . . 0.0 110.691 -179.663 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 10.6 mp -61.75 -41.08 97.2 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.81 0.338 . . . . 0.0 110.164 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 79.5 ttt-85 -54.91 -42.52 72.3 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.156 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -57.82 -50.48 73.13 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.504 -0.478 . . . . 0.0 110.335 -179.683 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 192' ' ' LEU . . . . . 0.534 ' N ' HD22 ' B' ' 192' ' ' LEU . 3.9 mm? -66.76 -42.91 85.4 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.851 0.358 . . . . 0.0 110.853 179.496 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 105.77 42.14 1.74 Allowed Glycine 0 CA--C 1.525 0.717 0 N-CA-C 111.154 -0.778 . . . . 0.0 111.154 -179.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 194' ' ' LEU . . . . . 0.487 ' N ' HD12 ' B' ' 194' ' ' LEU . 8.1 mp -96.46 -15.1 21.92 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 120.496 0.189 . . . . 0.0 110.682 179.643 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 29.4 m -138.27 161.92 30.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.773 0.321 . . . . 0.0 110.269 -179.771 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 196' ' ' VAL . . . . . 0.461 HG12 ' N ' ' B' ' 197' ' ' GLY . 61.9 t -141.87 157.99 20.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.535 179.42 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 197' ' ' GLY . . . . . 0.461 ' N ' HG12 ' B' ' 196' ' ' VAL . . . -129.53 149.38 18.66 Favored Glycine 0 CA--C 1.521 0.447 0 N-CA-C 110.625 -0.99 . . . . 0.0 110.625 179.437 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 198' ' ' ASP . . . . . 0.408 ' O ' HD12 ' B' ' 204' ' ' ILE . 17.8 t70 -112.48 110.66 20.98 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-O 120.863 0.363 . . . . 0.0 110.709 -179.711 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 14.4 tpt180 -75.52 128.52 35.49 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.472 179.837 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 200' ' ' ALA . . . . . . . . . . . . . . . -142.14 95.22 2.77 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.531 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 201' ' ' GLY . . . . . . . . . . . . . . . 58.42 -113.05 4.48 Favored Glycine 0 CA--C 1.524 0.599 0 N-CA-C 110.627 -0.989 . . . . 0.0 110.627 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 202' ' ' ARG . . . . . . . . . . . . . 84.8 mtt85 -106.36 23.85 13.48 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.653 0.263 . . . . 0.0 110.577 179.696 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 8.2 t -138.97 130.78 27.64 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-O 120.899 0.38 . . . . 0.0 110.188 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 204' ' ' ILE . . . . . 0.408 HD12 ' O ' ' B' ' 198' ' ' ASP . 1.2 tp -121.46 128.03 75.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.901 179.429 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 70.7 t -104.41 130.61 54.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.033 -0.53 . . . . 0.0 109.77 178.63 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 77.0 m-85 -102.59 132.7 48.51 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.468 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 36.1 p -150.07 169.26 21.65 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.029 -179.413 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 208' ' ' LEU . . . . . 0.619 ' N ' HD12 ' B' ' 208' ' ' LEU . 7.8 mp -68.78 149.18 49.29 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.566 -179.28 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 59.3 t80 -53.46 -43.81 68.42 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.547 179.709 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 40.7 p30 -144.47 179.9 6.97 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.42 -179.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 211' ' ' THR . . . . . 0.59 ' O ' ' HB3' ' B' ' 214' ' ' ALA . 25.4 m -96.16 -17.8 20.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.596 -179.92 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 212' ' ' HIS . . . . . . . . . . . . . 89.4 m-70 -40.77 -65.82 0.38 Allowed 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 121.38 0.61 . . . . 0.0 110.706 179.674 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 7.5 p -47.57 -34.45 3.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.345 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 214' ' ' ALA . . . . . 0.59 ' HB3' ' O ' ' B' ' 211' ' ' THR . . . -65.45 -38.25 89.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.08 179.491 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -60.89 -45.57 94.1 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.032 -179.772 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 216' ' ' LEU . . . . . 0.679 HD21 ' HA ' ' A' ' 101' ' ' ALA . 8.2 mp -61.09 -43.72 98.45 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.445 -0.502 . . . . 0.0 109.712 -179.579 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 217' ' ' LEU . . . . . 0.611 HD11 HD21 ' B' ' 155' ' ' LEU . 7.1 tp -64.47 -40.21 95.27 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.461 179.309 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 65.7 t0 -56.44 -46.31 80.35 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.028 -179.49 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 219' ' ' GLU . . . . . . . . . . . . . 16.7 tp10 -70.13 -48.94 55.36 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.146 179.724 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 220' ' ' ALA . . . . . 0.697 ' HA ' HD21 ' A' ' 97' ' ' LEU . . . -53.22 -47.53 68.89 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.331 179.584 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 4.5 mm -62.99 -44.6 99.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.597 -179.71 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 90.0 t80 -60.02 -42.82 95.18 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.985 -179.794 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 223' ' ' HIS . . . . . 0.483 ' CE1' HD12 ' B' ' 227' ' ' LEU . 47.8 t60 -68.41 -38.69 81.48 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.619 179.247 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 224' ' ' SER . . . . . 0.491 ' O ' ' N ' ' B' ' 228' ' ' HIS . 11.5 t -57.41 -48.78 78.19 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.648 -178.827 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 225' ' ' GLU . . . . . 0.457 ' C ' ' N ' ' B' ' 227' ' ' LEU . 96.0 mt-10 -77.14 -53.19 8.07 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.958 0.408 . . . . 0.0 111.428 179.111 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 86.2 t60 -49.05 -13.51 0.06 Allowed 'General case' 0 CA--C 1.518 -0.261 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.274 -178.794 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 227' ' ' LEU . . . . . 0.483 HD12 ' CE1' ' B' ' 223' ' ' HIS . 61.8 mt -142.72 -72.87 0.3 Allowed 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.9 179.917 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 228' ' ' HIS . . . . . 0.491 ' N ' ' O ' ' B' ' 224' ' ' SER . 20.3 t-80 75.97 74.57 0.09 Allowed 'General case' 0 C--N 1.328 -0.337 0 O-C-N 123.506 0.504 . . . . 0.0 110.427 -179.762 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 229' ' ' LEU . . . . . 0.543 ' N ' HD12 ' B' ' 229' ' ' LEU . 10.5 mp -62.9 -42.37 99.76 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.498 -179.761 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . 69.37 131.31 0.06 OUTLIER Glycine 0 CA--C 1.525 0.712 0 N-CA-C 110.922 -0.871 . . . . 0.0 110.922 -179.849 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 231' ' ' LEU . . . . . . . . . . . . . 2.2 pp -159.68 140.25 12.15 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.814 0.34 . . . . 0.0 110.586 179.902 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 232' ' ' SER . . . . . . . . . . . . . 39.8 t -163.05 43.26 0.12 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.356 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 233' ' ' ASP . . . . . . . . . . . . . 54.3 p-10 -83.27 169.91 15.2 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.588 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 234' ' ' ARG . . . . . . . . . . . . . 88.1 mtm180 -76.6 150.02 36.51 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.692 -179.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 235' ' ' HIS . . . . . . . . . . . . . 69.9 m-70 -44.94 149.73 0.81 Allowed Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.69 -179.361 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 236' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -66.05 -22.48 54.83 Favored 'Trans proline' 0 N--CA 1.493 1.478 0 C-N-CA 122.697 2.264 . . . . 0.0 112.096 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 237' ' ' SER . . . . . . . . . . . . . 47.5 t 46.4 -108.25 0.18 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.585 -179.693 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 238' ' ' ALA . . . . . . . . . . . . . . . 49.56 -160.11 0.06 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.581 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.745 0 CA-C-O 118.041 -1.421 . . . . 0.0 110.918 179.978 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.428 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 61.5 m170 -63.03 -44.89 94.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.732 0.301 . . . . 0.0 110.433 -179.813 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -83.15 -128.62 1.34 Allowed Glycine 0 CA--C 1.521 0.467 0 N-CA-C 110.69 -0.964 . . . . 0.0 110.69 179.864 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 33.9 m -127.88 132.85 68.4 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-O 120.777 0.322 . . . . 0.0 110.445 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 45.1 tt0 -89.73 124.32 34.52 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.367 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -88.34 118.29 5.05 Favored Glycine 0 CA--C 1.524 0.641 0 N-CA-C 110.756 -0.938 . . . . 0.0 110.756 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 88.6 mtm180 -78.64 144.08 35.76 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.678 0.275 . . . . 0.0 110.496 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.513 ' C ' ' HE ' ' A' ' 10' ' ' ARG . 18.7 p30 -81.59 133.89 35.43 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.561 -179.981 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.513 ' HE ' ' C ' ' A' ' 9' ' ' ASN . 0.0 OUTLIER -73.46 151.71 89.66 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.658 -179.495 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -67.98 154.75 71.96 Favored 'Trans proline' 0 C--N 1.309 -1.535 0 C-N-CA 122.722 2.281 . . . . 0.0 111.995 179.444 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 7.1 m -52.62 106.15 0.15 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.444 179.823 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -165.67 60.65 0.68 Allowed Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.432 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -72.83 41.38 0.54 Allowed 'Trans proline' 0 C--N 1.309 -1.549 0 C-N-CA 122.785 2.323 . . . . 0.0 111.938 -179.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.552 ' O ' ' N ' ' A' ' 17' ' ' SER . 71.0 mt -74.86 141.99 44.17 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.269 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.406 ' C ' ' O ' ' A' ' 15' ' ' LEU . 97.7 m-20 -35.64 -26.86 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.27 0 O-C-N 123.467 0.48 . . . . 0.0 110.645 -179.822 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.552 ' N ' ' O ' ' A' ' 15' ' ' LEU . 11.4 t -56.43 -48.16 77.55 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-O 121.362 0.601 . . . . 0.0 109.723 179.338 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.439 ' N ' ' O ' ' A' ' 15' ' ' LEU . 90.7 mm-40 -65.3 -47.48 76.45 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.02 179.42 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.712 ' O ' HG23 ' A' ' 23' ' ' VAL . . . -56.31 -29.12 60.82 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.237 -179.896 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -71.28 -49.71 40.2 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 120.867 -0.333 . . . . 0.0 110.152 179.554 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.25 -44.01 95.62 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.525 179.908 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -59.4 -49.36 78.09 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-O 121.162 0.506 . . . . 0.0 110.352 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.712 HG23 ' O ' ' A' ' 19' ' ' ALA . 84.4 t -61.71 -44.26 98.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.025 179.626 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.505 ' HB1' ' N ' ' B' ' 151' ' ' THR . . . -57.78 -41.9 82.99 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 120.876 0.37 . . . . 0.0 110.032 179.868 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 48.3 t -58.76 -44.84 90.69 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.021 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.453 ' OG1' ' O ' ' A' ' 23' ' ' VAL . 71.3 p -64.42 -47.28 79.73 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 120.989 0.423 . . . . 0.0 110.566 179.362 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 95.1 mt -63.95 -23.77 67.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.406 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.494 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 54.9 tt0 -75.65 -56.49 4.64 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.733 179.542 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.65 -55.1 39.38 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.786 -179.333 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.478 ' O ' ' O ' ' A' ' 31' ' ' ALA . 3.8 mm? -46.8 -35.14 5.92 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 -179.18 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.494 ' HB3' ' O ' ' A' ' 28' ' ' GLN . . . -55.07 -161.92 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.064 -0.517 . . . . 0.0 109.858 179.428 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.549 ' CB ' HH11 ' A' ' 35' ' ' ARG . 1.0 OUTLIER 81.86 114.41 0.03 OUTLIER Pre-proline 0 C--N 1.323 -0.544 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.182 179.827 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -49.19 -42.6 39.34 Favored 'Trans proline' 0 N--CA 1.496 1.641 0 C-N-CA 122.265 1.977 . . . . 0.0 112.957 -179.14 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 47.4 t -59.36 -45.54 91.11 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.881 -179.191 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.549 HH11 ' CB ' ' A' ' 32' ' ' THR . 84.6 mtt85 -62.03 -44.31 96.98 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.738 -0.385 . . . . 0.0 111.186 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -61.3 -47.59 85.27 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.476 -0.49 . . . . 0.0 110.96 -179.52 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.435 ' O ' ' OE1' ' A' ' 41' ' ' GLN . 20.2 ttm -56.54 -48.95 76.19 Favored 'General case' 0 C--N 1.319 -0.743 0 C-N-CA 120.285 -0.566 . . . . 0.0 110.301 -179.804 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 37.8 mm -63.5 -43.66 98.45 Favored 'Isoleucine or valine' 0 C--O 1.234 0.256 0 CA-C-O 121.045 0.45 . . . . 0.0 110.44 -179.752 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 57.8 mt -62.15 -39.75 93.66 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.456 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 18.0 m -60.55 -43.72 96.9 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.101 -0.5 . . . . 0.0 109.981 179.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.435 ' OE1' ' O ' ' A' ' 37' ' ' MET . 3.4 mp0 -61.31 -44.9 96.44 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.985 0.422 . . . . 0.0 110.041 179.809 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 97.9 mt -61.79 -40.23 94.47 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.066 -179.434 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.536 ' NH2' ' OD2' ' A' ' 99' ' ' ASP . 20.3 tpt180 -63.72 -37.67 88.21 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.951 179.974 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -56.95 -42.33 79.91 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.692 -178.54 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 169.38 -174.49 43.77 Favored Glycine 0 CA--C 1.527 0.786 0 N-CA-C 111.007 -0.837 . . . . 0.0 111.007 179.724 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -77.83 122.34 5.83 Favored 'Trans proline' 0 C--N 1.311 -1.408 0 C-N-CA 122.819 2.346 . . . . 0.0 111.663 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.441 ' H ' HD12 ' A' ' 47' ' ' LEU . 0.2 OUTLIER -150.16 95.89 3.55 Favored Pre-proline 0 CA--C 1.537 0.451 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.961 -179.248 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_exo -47.06 173.22 0.03 OUTLIER 'Trans proline' 0 C--N 1.306 -1.664 0 C-N-CA 122.495 2.13 . . . . 0.0 112.284 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 73.0 t -54.64 -45.02 72.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.433 -179.23 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 15.3 m -59.78 -40.24 87.62 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.22 0.533 . . . . 0.0 110.255 179.208 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 56.3 t0 -65.71 -38.98 90.68 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.16 179.517 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.6 ' O ' HD13 ' A' ' 52' ' ' LEU . 0.3 OUTLIER -62.46 -44.19 97.0 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-O 121.308 0.575 . . . . 0.0 110.028 -179.565 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.497 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -55.87 -48.44 75.57 Favored 'General case' 0 N--CA 1.444 -0.738 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 179.707 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 44.9 tp10 -56.48 -48.43 77.14 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.318 -0.553 . . . . 0.0 110.549 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -54.29 -58.07 8.8 Favored 'General case' 0 C--N 1.332 -0.163 0 C-N-CA 120.896 -0.322 . . . . 0.0 110.614 -179.467 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 90.6 mt -86.35 -73.16 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.417 179.775 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . 0.497 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 131.88 98.09 0.72 Allowed Glycine 0 N--CA 1.461 0.316 0 N-CA-C 111.055 -0.818 . . . . 0.0 111.055 -179.679 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 64.3 mtt 66.48 99.54 0.05 OUTLIER 'General case' 0 C--N 1.34 0.18 0 CA-C-O 120.767 0.317 . . . . 0.0 110.722 178.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.41 ' H ' ' H ' ' A' ' 60' ' ' GLN . 2.1 mt-10 -179.53 15.12 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.359 179.864 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.41 ' H ' ' H ' ' A' ' 59' ' ' GLU . 52.0 mt-30 -55.54 -36.9 67.29 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.549 -179.372 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 78.1 p -62.09 -49.29 76.53 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.821 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.34 -35.87 72.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.278 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 75.8 t -67.19 -52.95 37.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.596 -179.694 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 10.4 t -56.84 -42.29 79.38 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.248 -179.416 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -63.17 -49.8 72.88 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.816 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 86.6 mm-40 -63.72 -41.17 98.12 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.594 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.8 tp -62.52 -44.66 95.82 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.359 -179.679 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 70.4 mmt-85 -62.43 -42.42 99.44 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.848 0.356 . . . . 0.0 110.66 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 71.9 t -67.23 -54.37 24.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 C-N-CA 120.262 -0.575 . . . . 0.0 110.468 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 92.4 mt -58.49 -41.4 85.24 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.063 -179.323 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 73.5 ttt180 -58.55 -41.67 86.14 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.405 179.729 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 93.3 m-20 -57.65 -50.39 73.32 Favored 'General case' 0 C--N 1.332 -0.171 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.455 -179.421 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.8 mt -67.7 -40.76 84.3 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.934 0.397 . . . . 0.0 110.407 -179.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 103.09 78.76 1.31 Allowed Glycine 0 CA--C 1.52 0.398 0 N-CA-C 110.872 -0.891 . . . . 0.0 110.872 -179.644 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.424 HD11 HG21 ' A' ' 94' ' ' VAL . 6.7 tp -144.9 -9.35 0.61 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.943 0.401 . . . . 0.0 110.793 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 33.8 m -139.05 158.34 29.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.454 -179.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.476 HG12 ' N ' ' A' ' 78' ' ' GLY . 48.4 t -143.99 157.69 15.87 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.577 -179.793 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.476 ' N ' HG12 ' A' ' 77' ' ' VAL . . . -134.44 144.48 16.45 Favored Glycine 0 CA--C 1.521 0.463 0 N-CA-C 110.388 -1.085 . . . . 0.0 110.388 179.623 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 46.9 t0 -103.51 106.54 17.08 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 120.919 0.39 . . . . 0.0 110.343 179.519 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -80.9 132.46 35.44 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.674 179.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.593 ' C ' ' H ' ' A' ' 83' ' ' ARG . . . -131.13 147.68 52.64 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.352 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -65.59 33.92 0.13 Allowed Glycine 0 CA--C 1.527 0.82 0 N-CA-C 111.16 -0.776 . . . . 0.0 111.16 -179.827 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.593 ' H ' ' C ' ' A' ' 81' ' ' ALA . 8.3 ptp85 -157.26 -26.05 0.09 Allowed 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 120.687 0.279 . . . . 0.0 110.261 179.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . 0.414 ' OG ' ' O ' ' A' ' 83' ' ' ARG . 18.5 m -173.91 167.43 4.33 Favored 'General case' 0 CA--C 1.518 -0.287 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 -179.727 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -122.41 130.03 74.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.901 179.262 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 46.6 t -109.16 133.12 55.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.218 178.855 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -106.88 131.47 53.93 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.288 179.749 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.435 ' O ' ' O ' ' A' ' 77' ' ' VAL . 99.9 p -150.09 166.88 28.42 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.487 ' O ' ' N ' ' A' ' 91' ' ' ASP . 0.3 OUTLIER -78.9 154.16 29.93 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.175 -179.361 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.402 ' CE2' ' OG1' ' A' ' 92' ' ' THR . 71.0 t80 -46.17 -15.55 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.434 179.688 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.487 ' N ' ' O ' ' A' ' 89' ' ' LEU . 52.8 t0 41.94 89.81 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.189 179.055 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . 0.459 ' OG1' ' O ' ' A' ' 91' ' ' ASP . 2.1 m -169.58 -133.8 0.02 OUTLIER 'General case' 0 C--O 1.236 0.353 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.56 179.656 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . 0.444 ' H ' HG22 ' A' ' 92' ' ' THR . 40.4 m80 -55.08 -53.06 60.65 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.021 -179.89 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.424 HG21 HD11 ' A' ' 75' ' ' LEU . 95.3 t -49.78 -39.53 14.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.245 179.754 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.52 -41.44 98.86 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.485 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 58.6 tt0 -60.65 -46.34 90.71 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.006 0.432 . . . . 0.0 110.11 -179.865 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.463 HD11 ' N ' ' B' ' 220' ' ' ALA . 3.7 mm? -62.32 -43.14 99.52 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.433 179.677 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.504 ' O ' HG22 ' A' ' 102' ' ' ILE . 62.3 tp -65.06 -39.29 93.07 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.422 179.869 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . 0.536 ' OD2' ' NH2' ' A' ' 43' ' ' ARG . 94.2 m-20 -62.71 -39.84 95.27 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.154 0.502 . . . . 0.0 110.839 -178.983 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.464 ' OE2' ' OE2' ' B' ' 219' ' ' GLU . 97.5 mt-10 -74.16 -52.62 11.93 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.825 179.67 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.447 ' N ' HD11 ' B' ' 216' ' ' LEU . . . -57.89 -48.37 80.06 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.965 -179.629 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.561 HG23 ' N ' ' A' ' 103' ' ' TYR . 10.4 tp -64.73 -46.1 93.2 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 CA-C-O 120.892 0.377 . . . . 0.0 111.111 -179.096 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' TYR . . . . . 0.561 ' N ' HG23 ' A' ' 102' ' ' ILE . 91.0 t80 -62.98 -43.97 97.31 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.783 -179.422 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 3.4 m-70 -67.31 -41.44 85.32 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.756 -179.734 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 6.4 t -67.93 -44.29 77.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.977 0.417 . . . . 0.0 110.744 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 15.1 tm-20 -67.63 -29.2 68.46 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.569 -179.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . 0.535 ' O ' ' N ' ' A' ' 109' ' ' HIS . 18.7 t60 -51.37 -67.85 0.22 Allowed 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.262 -178.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.498 ' N ' HD22 ' A' ' 108' ' ' LEU . 4.4 mm? -41.3 91.11 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.027 0.441 . . . . 0.0 110.401 -179.779 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . 0.535 ' N ' ' O ' ' A' ' 107' ' ' HIS . 82.5 t60 -107.75 125.19 51.11 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.567 179.847 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.645 ' N ' HD12 ' A' ' 110' ' ' LEU . 9.3 mp -62.33 -42.75 99.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.295 -179.382 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . 0.411 ' O ' ' O ' ' A' ' 110' ' ' LEU . . . 57.9 114.6 0.01 OUTLIER Glycine 0 CA--C 1.526 0.727 0 N-CA-C 110.775 -0.93 . . . . 0.0 110.775 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.642 HD12 ' N ' ' A' ' 112' ' ' LEU . 8.8 mp 54.71 41.54 31.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.768 0.318 . . . . 0.0 110.418 179.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 14.9 m 51.76 -96.63 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.405 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 42.4 p30 -153.88 -173.58 4.63 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.709 -179.735 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 79.3 mtp85 -62.15 -39.86 94.04 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.201 -179.829 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 3.1 m-70 -62.05 149.89 85.07 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.607 -179.651 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -66.63 128.52 19.22 Favored 'Trans proline' 0 N--CA 1.494 1.522 0 C-N-CA 122.511 2.141 . . . . 0.0 111.995 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 43.0 t -63.08 -44.1 96.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.555 179.483 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -167.4 154.53 8.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.639 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.671 0 CA-C-O 118.052 -1.416 . . . . 0.0 110.963 179.896 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.172 0 N-CA-C 109.579 -1.408 . . . . 0.0 109.579 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 54.7 m170 -61.31 -45.2 95.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.728 0.299 . . . . 0.0 110.609 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 123' ' ' GLY . . . . . . . . . . . . . . . -85.83 -118.18 0.97 Allowed Glycine 0 CA--C 1.523 0.532 0 N-CA-C 110.62 -0.992 . . . . 0.0 110.62 179.783 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 20.5 m -132.46 151.25 34.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 120.802 0.335 . . . . 0.0 110.326 179.682 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 125' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -108.43 120.4 42.28 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.456 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -82.95 117.65 4.45 Favored Glycine 0 CA--C 1.525 0.66 0 N-CA-C 110.723 -0.951 . . . . 0.0 110.723 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 127' ' ' ARG . . . . . . . . . . . . . 89.9 mtm180 -80.09 139.33 36.92 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.775 0.321 . . . . 0.0 110.519 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 128' ' ' ASN . . . . . 0.567 ' C ' ' HE ' ' B' ' 129' ' ' ARG . 22.0 p30 -75.9 134.2 40.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.586 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 129' ' ' ARG . . . . . 0.567 ' HE ' ' C ' ' B' ' 128' ' ' ASN . 0.0 OUTLIER -75.19 151.67 85.91 Favored Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.495 -179.603 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -67.57 152.98 77.59 Favored 'Trans proline' 0 N--CA 1.494 1.516 0 C-N-CA 122.642 2.228 . . . . 0.0 112.107 179.432 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 33.3 m -50.82 103.21 0.05 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.347 179.806 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 132' ' ' ALA . . . . . . . . . . . . . . . -161.52 58.26 0.91 Allowed Pre-proline 0 C--N 1.329 -0.319 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.502 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 133' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -71.45 41.79 0.44 Allowed 'Trans proline' 0 N--CA 1.494 1.555 0 C-N-CA 122.823 2.348 . . . . 0.0 111.926 -179.81 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . 0.557 ' O ' ' N ' ' B' ' 136' ' ' SER . 61.0 mt -76.57 142.67 40.69 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.283 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 135' ' ' ASP . . . . . 0.408 ' C ' ' O ' ' B' ' 134' ' ' LEU . 98.9 m-20 -34.97 -28.01 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.255 0 O-C-N 123.496 0.497 . . . . 0.0 110.639 -179.851 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . 0.557 ' N ' ' O ' ' B' ' 134' ' ' LEU . 9.9 t -55.15 -48.68 73.38 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.236 0.541 . . . . 0.0 109.788 179.514 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 137' ' ' GLN . . . . . 0.414 ' N ' ' O ' ' B' ' 134' ' ' LEU . 95.6 mm-40 -65.36 -47.6 75.88 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.937 179.535 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 138' ' ' ALA . . . . . 0.609 ' O ' HG23 ' B' ' 142' ' ' VAL . . . -56.02 -29.81 60.93 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.196 -179.837 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -71.28 -49.88 38.34 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 120.888 0.375 . . . . 0.0 110.156 179.653 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -61.1 -41.14 96.12 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.529 179.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -61.21 -49.86 75.45 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-O 121.214 0.531 . . . . 0.0 110.427 179.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 142' ' ' VAL . . . . . 0.609 HG23 ' O ' ' B' ' 138' ' ' ALA . 93.5 t -61.78 -44.46 98.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.145 179.697 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 143' ' ' ALA . . . . . 0.477 ' HB1' ' N ' ' A' ' 32' ' ' THR . . . -57.01 -42.19 79.88 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 120.804 0.335 . . . . 0.0 110.167 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 14.0 t -58.71 -44.97 90.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.98 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 77.5 p -64.2 -46.36 84.27 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 120.967 0.413 . . . . 0.0 110.451 179.466 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 95.4 mt -64.51 -23.4 67.26 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.435 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 147' ' ' GLN . . . . . 0.484 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 57.1 tt0 -75.64 -56.36 4.76 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.785 179.527 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -59.12 -55.2 38.03 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.766 -179.393 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.467 ' O ' ' O ' ' B' ' 150' ' ' ALA . 3.8 mm? -46.66 -36.38 6.99 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 -179.127 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 150' ' ' ALA . . . . . 0.484 ' HB3' ' O ' ' B' ' 147' ' ' GLN . . . -54.86 -162.2 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.927 179.602 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 151' ' ' THR . . . . . 0.562 ' CB ' HH11 ' B' ' 154' ' ' ARG . 0.6 OUTLIER 82.79 115.07 0.03 OUTLIER Pre-proline 0 CA--C 1.54 0.564 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.294 179.694 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -48.98 -42.68 37.74 Favored 'Trans proline' 0 N--CA 1.496 1.618 0 C-N-CA 122.18 1.92 . . . . 0.0 113.063 -179.303 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 39.6 t -60.16 -45.97 91.28 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.976 -179.131 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 154' ' ' ARG . . . . . 0.562 HH11 ' CB ' ' B' ' 151' ' ' THR . 84.4 mtt85 -62.56 -43.6 98.41 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.125 -179.722 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 155' ' ' LEU . . . . . 0.415 HD13 ' HA ' ' B' ' 155' ' ' LEU . 4.2 mm? -62.69 -47.0 85.52 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.72 -0.392 . . . . 0.0 111.036 -179.479 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 36.4 ttp -58.34 -48.92 79.01 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.266 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 35.3 mm -63.28 -43.84 98.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 121.054 0.454 . . . . 0.0 110.371 179.76 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 36.9 mt -61.5 -40.68 95.48 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.222 -179.709 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 19.9 m -59.97 -45.14 93.66 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.005 179.694 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -58.03 -45.1 87.5 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.676 -0.41 . . . . 0.0 109.991 179.864 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 161' ' ' LEU . . . . . . . . . . . . . 97.0 mt -62.03 -40.07 94.47 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.122 0.486 . . . . 0.0 109.996 -179.47 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 162' ' ' ARG . . . . . 0.548 ' NH2' ' OD2' ' B' ' 218' ' ' ASP . 21.5 tpt180 -63.52 -37.99 89.41 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.951 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 98.4 m-20 -56.57 -42.09 78.04 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.588 -178.64 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . 169.43 -175.91 43.56 Favored Glycine 0 CA--C 1.528 0.876 0 N-CA-C 110.997 -0.841 . . . . 0.0 110.997 179.665 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -76.99 123.26 6.66 Favored 'Trans proline' 0 N--CA 1.492 1.413 0 C-N-CA 122.856 2.371 . . . . 0.0 111.593 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 166' ' ' LEU . . . . . 0.449 ' H ' HD12 ' B' ' 166' ' ' LEU . 0.2 OUTLIER -150.61 96.38 3.39 Favored Pre-proline 0 CA--C 1.538 0.504 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.016 -179.238 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_exo -47.06 173.31 0.03 OUTLIER 'Trans proline' 0 C--N 1.306 -1.71 0 C-N-CA 122.456 2.104 . . . . 0.0 112.309 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . 81.7 t -54.77 -45.2 73.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.43 -179.292 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 169' ' ' THR . . . . . . . . . . . . . 15.7 m -59.99 -40.28 88.61 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.186 0.517 . . . . 0.0 110.229 179.199 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -65.45 -38.64 90.45 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.191 179.297 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 171' ' ' LEU . . . . . 0.597 ' O ' HD13 ' B' ' 171' ' ' LEU . 0.3 OUTLIER -62.63 -44.82 95.33 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.272 0.558 . . . . 0.0 110.011 -179.587 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 172' ' ' ALA . . . . . 0.486 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -55.66 -48.07 75.64 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 179.782 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 43.6 tp10 -56.04 -48.39 76.07 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.308 -0.557 . . . . 0.0 110.502 179.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -54.82 -58.35 7.93 Favored 'General case' 0 C--N 1.333 -0.136 0 C-N-CA 120.749 -0.38 . . . . 0.0 110.776 -179.511 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 87.7 mt -86.62 -72.98 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.454 179.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 176' ' ' GLY . . . . . 0.486 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 130.54 99.41 0.84 Allowed Glycine 0 N--CA 1.461 0.323 0 N-CA-C 111.119 -0.792 . . . . 0.0 111.119 -179.779 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 62.5 mtt 66.27 95.71 0.06 Allowed 'General case' 0 CA--C 1.521 -0.172 0 CA-C-O 120.887 0.375 . . . . 0.0 110.745 178.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -176.71 14.65 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.404 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 54.8 mt-30 -55.79 -37.07 68.11 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.64 -179.247 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 64.3 p -61.49 -48.43 81.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.036 -179.726 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -59.2 -35.4 73.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.233 -179.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 97.5 t -67.12 -52.91 38.38 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.101 0 C-N-CA 120.467 -0.493 . . . . 0.0 110.726 -179.713 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 10.7 t -57.11 -42.18 80.33 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.289 -179.576 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 86.0 t60 -63.42 -50.27 70.48 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.905 -179.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 90.6 mm-40 -63.69 -40.48 96.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.949 0.404 . . . . 0.0 110.668 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 8.6 tp -62.52 -44.94 95.13 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.403 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 73.1 mmt-85 -62.46 -42.31 99.38 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.746 -179.761 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 77.7 t -66.34 -54.58 24.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 C-N-CA 120.179 -0.608 . . . . 0.0 110.506 -179.741 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 87.2 mt -58.83 -41.15 86.19 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 -179.251 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 71.8 ttt180 -57.95 -41.37 82.69 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.272 179.704 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 -59.82 -49.87 76.03 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 120.488 -0.485 . . . . 0.0 110.447 -179.33 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 192' ' ' LEU . . . . . 0.4 ' N ' HD23 ' B' ' 192' ' ' LEU . 9.2 mt -67.55 -39.41 84.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.816 0.341 . . . . 0.0 110.464 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 101.28 80.98 1.54 Allowed Glycine 0 N--CA 1.462 0.42 0 N-CA-C 110.727 -0.949 . . . . 0.0 110.727 -179.639 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 194' ' ' LEU . . . . . 0.419 HD21 HD11 ' B' ' 149' ' ' LEU . 4.9 tp -147.47 -9.68 0.42 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.777 0.322 . . . . 0.0 110.768 -179.932 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 26.7 m -140.05 159.18 26.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.412 -179.636 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 196' ' ' VAL . . . . . 0.515 HG12 ' N ' ' B' ' 197' ' ' GLY . 47.7 t -145.62 159.62 12.46 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.493 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 197' ' ' GLY . . . . . 0.515 ' N ' HG12 ' B' ' 196' ' ' VAL . . . -135.68 145.21 17.22 Favored Glycine 0 CA--C 1.523 0.563 0 N-CA-C 110.409 -1.077 . . . . 0.0 110.409 179.615 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 67.3 t0 -103.21 106.21 16.67 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 120.868 0.366 . . . . 0.0 110.337 179.564 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 3.4 tmt_? -80.57 134.81 35.97 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.562 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 200' ' ' ALA . . . . . 0.595 ' C ' ' H ' ' B' ' 202' ' ' ARG . . . -133.25 148.42 51.98 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.407 -179.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 201' ' ' GLY . . . . . . . . . . . . . . . -65.38 31.08 0.12 Allowed Glycine 0 CA--C 1.524 0.655 0 N-CA-C 111.21 -0.756 . . . . 0.0 111.21 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 202' ' ' ARG . . . . . 0.595 ' H ' ' C ' ' B' ' 200' ' ' ALA . 8.1 ptp85 -153.08 -27.06 0.15 Allowed 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 110.246 -0.279 . . . . 0.0 110.246 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 19.0 m -174.45 169.46 3.73 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 -179.633 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 1.3 tp -122.77 132.26 71.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.021 179.352 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 47.2 t -111.74 132.55 60.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.179 178.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 96.3 m-85 -106.07 131.97 52.7 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.417 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 207' ' ' SER . . . . . 0.443 ' O ' ' O ' ' B' ' 196' ' ' VAL . 40.6 p -150.52 167.26 27.72 Favored 'General case' 0 CA--C 1.52 -0.196 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 208' ' ' LEU . . . . . 0.475 ' O ' HD12 ' B' ' 208' ' ' LEU . 0.3 OUTLIER -78.97 154.12 29.81 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.224 -179.158 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 66.4 t80 -46.36 -15.85 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.805 0.336 . . . . 0.0 110.529 179.647 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 210' ' ' ASP . . . . . 0.473 ' N ' ' O ' ' B' ' 208' ' ' LEU . 35.5 t0 42.45 89.72 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.21 179.107 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 211' ' ' THR . . . . . 0.489 HG22 ' H ' ' B' ' 212' ' ' HIS . 2.3 m -169.32 -134.77 0.02 OUTLIER 'General case' 0 C--O 1.238 0.47 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.471 179.634 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 212' ' ' HIS . . . . . 0.489 ' H ' HG22 ' B' ' 211' ' ' THR . 40.4 m80 -55.36 -53.51 55.3 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.02 -179.904 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 92.9 t -48.9 -38.88 11.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.214 179.741 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 214' ' ' ALA . . . . . . . . . . . . . . . -63.26 -42.24 99.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.347 179.831 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 58.8 tt0 -58.78 -46.62 87.1 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.073 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 216' ' ' LEU . . . . . 0.457 ' CD2' ' N ' ' B' ' 216' ' ' LEU . 3.5 mm? -61.99 -42.69 99.42 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.441 179.647 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 217' ' ' LEU . . . . . 0.476 ' O ' HG22 ' B' ' 221' ' ' ILE . 58.1 tp -65.4 -39.97 92.83 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.509 179.75 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 218' ' ' ASP . . . . . 0.548 ' OD2' ' NH2' ' B' ' 162' ' ' ARG . 98.8 m-20 -62.46 -40.16 95.74 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.163 0.506 . . . . 0.0 110.975 -178.941 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 219' ' ' GLU . . . . . 0.464 ' OE2' ' OE2' ' A' ' 100' ' ' GLU . 97.0 mt-10 -74.36 -53.45 9.62 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.807 179.564 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 220' ' ' ALA . . . . . 0.463 ' N ' HD11 ' A' ' 97' ' ' LEU . . . -56.8 -48.75 77.25 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.852 -179.305 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 221' ' ' ILE . . . . . 0.54 HG23 ' N ' ' B' ' 222' ' ' TYR . 3.8 tp -64.94 -45.76 93.77 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.441 0 C-N-CA 120.571 -0.452 . . . . 0.0 111.11 -179.174 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 222' ' ' TYR . . . . . 0.54 ' N ' HG23 ' B' ' 221' ' ' ILE . 90.4 t80 -62.36 -43.75 98.09 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.547 -179.46 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 223' ' ' HIS . . . . . . . . . . . . . 2.9 m-70 -67.47 -41.45 84.58 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.7 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 6.2 t -68.02 -44.5 76.37 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.915 0.388 . . . . 0.0 110.834 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 15.3 tm-20 -67.81 -28.78 67.87 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.664 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 226' ' ' HIS . . . . . 0.516 ' O ' ' N ' ' B' ' 228' ' ' HIS . 15.7 t60 -51.26 -68.03 0.2 Allowed 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.263 -178.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 227' ' ' LEU . . . . . 0.484 HD22 ' N ' ' B' ' 227' ' ' LEU . 4.4 mm? -41.68 92.66 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.079 0.466 . . . . 0.0 110.386 -179.821 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 228' ' ' HIS . . . . . 0.516 ' N ' ' O ' ' B' ' 226' ' ' HIS . 85.4 t60 -108.5 125.3 51.64 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.599 179.765 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 229' ' ' LEU . . . . . 0.54 ' N ' HD12 ' B' ' 229' ' ' LEU . 10.8 mp -61.81 -41.94 98.39 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.209 -179.602 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 230' ' ' GLY . . . . . 0.41 ' O ' ' O ' ' B' ' 229' ' ' LEU . . . 57.29 113.34 0.01 OUTLIER Glycine 0 CA--C 1.524 0.646 0 N-CA-C 110.899 -0.88 . . . . 0.0 110.899 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 231' ' ' LEU . . . . . 0.625 ' N ' HD12 ' B' ' 231' ' ' LEU . 8.7 mp 54.92 41.76 31.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.805 0.336 . . . . 0.0 110.485 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 232' ' ' SER . . . . . . . . . . . . . 30.8 m 52.41 -98.77 0.07 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.558 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 233' ' ' ASP . . . . . . . . . . . . . 50.2 p30 -152.35 -174.93 5.06 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.583 -179.752 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 234' ' ' ARG . . . . . . . . . . . . . 79.0 mtp85 -60.43 -41.67 94.5 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.422 -179.908 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 235' ' ' HIS . . . . . . . . . . . . . 2.6 m-70 -60.5 150.27 74.67 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.761 -179.63 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 236' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -66.86 128.59 19.1 Favored 'Trans proline' 0 N--CA 1.494 1.516 0 C-N-CA 122.52 2.146 . . . . 0.0 112.038 179.684 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 237' ' ' SER . . . . . . . . . . . . . 42.0 t -63.37 -44.07 95.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.516 179.653 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 238' ' ' ALA . . . . . . . . . . . . . . . -166.97 154.15 8.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.536 -179.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.72 0 CA-C-O 118.041 -1.422 . . . . 0.0 110.937 179.897 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.261 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.413 ' O ' ' ND1' ' A' ' 3' ' ' HIS . 49.7 t-80 47.91 41.54 14.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.817 0.341 . . . . 0.0 110.538 -179.979 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -176.7 -178.57 46.56 Favored Glycine 0 CA--C 1.521 0.442 0 N-CA-C 110.815 -0.914 . . . . 0.0 110.815 179.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 33.7 m -120.83 131.02 73.95 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 CA-C-O 120.853 0.359 . . . . 0.0 110.57 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 72.8 mm-40 -61.59 -64.81 0.82 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.55 -179.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 146.0 149.28 4.96 Favored Glycine 0 CA--C 1.524 0.611 0 N-CA-C 110.894 -0.882 . . . . 0.0 110.894 179.774 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 84.6 mtt85 -64.92 -41.32 95.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.86 0.362 . . . . 0.0 110.636 179.83 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 90.8 m-20 52.83 56.72 7.2 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.689 179.74 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 85.8 mtm180 -68.64 147.93 98.03 Favored Pre-proline 0 N--CA 1.452 -0.357 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.755 -179.464 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -70.54 146.57 55.74 Favored 'Trans proline' 0 C--N 1.309 -1.522 0 C-N-CA 122.698 2.265 . . . . 0.0 111.956 179.583 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 40.7 t -106.58 95.76 5.97 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.481 179.472 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -168.35 149.41 4.59 Favored Pre-proline 0 N--CA 1.45 -0.473 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.813 179.609 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -66.89 143.48 66.74 Favored 'Trans proline' 0 C--N 1.31 -1.453 0 C-N-CA 122.784 2.322 . . . . 0.0 111.736 179.594 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.841 HD23 ' H ' ' A' ' 15' ' ' LEU . 1.1 pt? -105.48 2.27 28.38 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.72 179.635 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.454 ' C ' ' O ' ' A' ' 15' ' ' LEU . 22.8 p-10 -33.48 -45.43 0.16 Allowed 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.948 0.404 . . . . 0.0 110.673 -179.121 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 78.3 p -54.74 -49.69 70.19 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.299 178.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.534 ' N ' ' O ' ' A' ' 15' ' ' LEU . 11.1 tp-100 -62.44 -45.1 94.59 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.308 -0.405 . . . . 0.0 109.909 179.808 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.557 ' O ' HG23 ' A' ' 23' ' ' VAL . . . -57.14 -29.41 63.56 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.377 179.914 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -72.72 -51.73 18.04 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 121.201 0.524 . . . . 0.0 110.416 179.547 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.2 -41.08 97.23 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.954 179.76 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 59.4 tt0 -64.92 -53.3 48.68 Favored 'General case' 0 C--O 1.241 0.654 0 CA-C-O 121.279 0.561 . . . . 0.0 110.902 -179.412 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.557 HG23 ' O ' ' A' ' 19' ' ' ALA . 96.6 t -61.56 -44.29 98.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.183 179.633 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -54.71 -42.53 71.61 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 179.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.6 t -58.81 -44.77 90.89 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 179.736 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 12.0 m -63.3 -45.73 90.0 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.26 179.024 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 95.7 mt -64.85 -22.28 66.96 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.523 179.717 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.524 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 58.1 tt0 -74.77 -55.66 5.6 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.425 179.49 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.66 -55.58 33.31 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.375 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.509 ' O ' ' O ' ' A' ' 31' ' ' ALA . 89.9 mt -44.94 -34.64 2.49 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.312 -179.565 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.524 ' HB3' ' O ' ' A' ' 28' ' ' GLN . . . -56.41 -139.97 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 O-C-N 123.517 0.511 . . . . 0.0 110.568 179.152 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.456 ' O ' ' O ' ' A' ' 31' ' ' ALA . 85.4 m 57.23 115.3 0.02 OUTLIER Pre-proline 0 C--N 1.323 -0.575 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.547 179.784 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -49.55 -46.76 25.41 Favored 'Trans proline' 0 N--CA 1.493 1.465 0 C-N-CA 122.371 2.047 . . . . 0.0 112.722 -179.337 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 57.9 m -62.87 -46.82 86.05 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.307 -178.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.2 tpp180 -63.01 -47.62 82.3 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.448 -178.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.584 HD23 ' O ' ' A' ' 36' ' ' LEU . 3.2 tt -60.38 -53.27 59.56 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.439 -178.636 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 62.1 ttp -50.77 -48.3 59.37 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-O 120.909 0.385 . . . . 0.0 110.167 179.776 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 5.5 mm -62.26 -43.83 98.44 Favored 'Isoleucine or valine' 0 C--O 1.239 0.519 0 CA-C-O 121.091 0.472 . . . . 0.0 110.525 179.501 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 14.3 mt -61.79 -41.11 97.32 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.288 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 9.8 m -58.36 -40.44 82.26 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.01 -0.541 . . . . 0.0 109.672 179.539 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.588 HE22 HD11 ' A' ' 56' ' ' ILE . 51.6 mt-30 -61.85 -44.28 97.15 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.469 179.499 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.517 ' O ' ' N ' ' A' ' 44' ' ' ASN . 80.5 mt -63.46 -31.57 72.76 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.127 179.472 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.548 HH21 ' CG ' ' A' ' 99' ' ' ASP . 33.4 tpt85 -33.9 -32.5 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 O-C-N 123.534 0.521 . . . . 0.0 110.866 -179.593 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.517 ' N ' ' O ' ' A' ' 42' ' ' LEU . 81.2 m-20 -72.44 -84.22 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.43 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 149.73 -76.37 0.24 Allowed Glycine 0 CA--C 1.527 0.82 0 N-CA-C 110.882 -0.887 . . . . 0.0 110.882 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -68.71 84.25 0.51 Allowed 'Trans proline' 0 C--N 1.307 -1.652 0 C-N-CA 122.742 2.294 . . . . 0.0 112.328 -179.379 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -156.9 68.07 4.33 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-O 121.045 0.45 . . . . 0.0 110.108 -179.747 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_exo -45.07 170.52 0.02 OUTLIER 'Trans proline' 0 C--N 1.298 -2.107 0 C-N-CA 122.416 2.078 . . . . 0.0 112.168 -179.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 80.8 t -54.32 -45.44 68.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.335 -179.593 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 15.1 m -61.34 -39.23 89.8 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.16 0.505 . . . . 0.0 110.292 179.117 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -66.31 -41.29 89.9 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.106 179.686 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.616 ' O ' HD13 ' A' ' 52' ' ' LEU . 0.2 OUTLIER -61.77 -42.58 99.17 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.775 -179.764 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.577 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -56.37 -47.78 78.19 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 179.323 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -54.64 -45.27 73.75 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.686 -0.406 . . . . 0.0 109.939 179.639 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -55.52 -57.59 11.27 Favored 'General case' 0 C--N 1.333 -0.139 0 C-N-CA 120.763 -0.375 . . . . 0.0 110.649 179.687 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.588 HD11 HE22 ' A' ' 41' ' ' GLN . 95.3 mt -80.48 -69.11 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.389 179.36 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . 0.577 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 131.95 75.93 0.12 Allowed Glycine 0 CA--C 1.521 0.438 0 N-CA-C 110.931 -0.868 . . . . 0.0 110.931 179.817 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.438 ' CB ' ' O ' ' A' ' 57' ' ' GLY . 1.1 tmm? 77.72 95.91 0.06 Allowed 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.708 179.581 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 19.9 tp10 -174.06 34.25 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.18 179.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -69.63 -20.91 63.59 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.957 -179.291 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 77.9 p -69.17 -43.55 74.03 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.958 -179.679 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.25 -35.79 81.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.266 179.764 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 87.0 t -66.97 -51.84 50.35 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.232 0 C-N-CA 120.727 -0.389 . . . . 0.0 110.433 -179.729 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 51.7 m -55.24 -44.04 75.14 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.53 -0.468 . . . . 0.0 110.358 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . 0.408 ' O ' HG22 ' A' ' 69' ' ' VAL . 76.1 m-70 -68.42 -44.1 75.73 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.033 179.733 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 64.9 mt-30 -60.77 -40.62 93.18 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.381 -179.693 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -68.06 -39.85 82.88 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 120.975 0.417 . . . . 0.0 110.561 179.141 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.548 ' NH1' HD21 ' A' ' 72' ' ' ASN . 17.5 tpt85 -58.81 -47.19 85.64 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.617 -178.916 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.605 HG23 ' N ' ' A' ' 70' ' ' LEU . 27.6 m -75.24 -53.05 17.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.525 179.902 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.605 ' N ' HG23 ' A' ' 69' ' ' VAL . 69.5 mt -52.94 -38.97 62.5 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 -179.612 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 78.4 ttt180 -68.45 -42.37 78.91 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.481 178.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.548 HD21 ' NH1' ' A' ' 68' ' ' ARG . 99.1 m-20 -60.08 -52.41 65.47 Favored 'General case' 0 C--N 1.333 -0.126 0 C-N-CA 120.646 -0.422 . . . . 0.0 110.426 -179.476 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.535 HD22 ' N ' ' A' ' 73' ' ' LEU . 3.9 mm? -67.28 -39.95 86.09 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.679 178.954 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 96.61 98.55 1.89 Allowed Glycine 0 CA--C 1.523 0.575 0 N-CA-C 110.938 -0.865 . . . . 0.0 110.938 -179.493 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.9 tp -163.05 -7.39 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.816 0.341 . . . . 0.0 110.76 179.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 33.6 m -140.61 163.37 22.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.271 -179.867 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.403 HG23 ' CD2' ' A' ' 90' ' ' TYR . 37.1 t -139.96 154.39 23.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.443 179.796 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -143.45 152.2 23.91 Favored Glycine 0 CA--C 1.522 0.486 0 N-CA-C 110.802 -0.919 . . . . 0.0 110.802 179.323 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . 0.452 ' OD1' ' N ' ' A' ' 79' ' ' ASP . 3.9 p-10 -133.08 107.18 8.07 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.667 0.27 . . . . 0.0 110.327 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 62.2 ttp180 -88.39 136.6 32.91 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.575 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -139.95 94.9 2.82 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.375 179.43 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 64.17 -115.7 8.21 Favored Glycine 0 CA--C 1.524 0.599 0 N-CA-C 110.395 -1.082 . . . . 0.0 110.395 -179.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 44.0 mmm-85 -94.83 -2.85 50.02 Favored 'General case' 0 C--N 1.33 -0.282 0 O-C-N 122.884 -0.186 . . . . 0.0 110.542 179.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . 0.402 ' O ' ' HB ' ' A' ' 85' ' ' ILE . 12.6 p -104.11 178.21 4.62 Favored 'General case' 0 CA--C 1.513 -0.456 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 179.899 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.504 HD11 ' CD2' ' A' ' 87' ' ' TYR . 0.0 OUTLIER 176.91 153.51 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 123.706 0.629 . . . . 0.0 110.682 179.636 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.466 ' N ' HD13 ' A' ' 85' ' ' ILE . 48.0 t -136.24 124.74 36.68 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.225 0 CA-C-O 120.858 0.361 . . . . 0.0 111.066 178.486 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.504 ' CD2' HD11 ' A' ' 85' ' ' ILE . 8.6 m-85 -108.27 126.08 52.41 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.076 178.904 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 38.6 m -148.65 166.72 27.49 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.365 -179.832 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 10.8 mt -61.65 152.42 30.85 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.272 -179.464 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.403 ' CD2' HG23 ' A' ' 77' ' ' VAL . 6.9 t80 -54.6 -49.43 70.48 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.43 -179.349 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 81.5 m-20 -130.99 -180.0 5.66 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 121.018 0.437 . . . . 0.0 110.373 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . 0.586 ' O ' ' HB3' ' A' ' 95' ' ' ALA . 19.1 m -95.37 -18.15 20.99 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.44 -179.879 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . 0.507 ' CG ' ' ND1' ' B' ' 223' ' ' HIS . 84.3 m-70 -43.46 -63.85 0.75 Allowed 'General case' 0 C--O 1.236 0.373 0 CA-C-O 120.978 0.418 . . . . 0.0 110.413 179.775 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 29.5 m -48.7 -35.02 6.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.189 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.586 ' HB3' ' O ' ' A' ' 92' ' ' THR . . . -64.41 -37.65 88.25 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.231 179.317 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.423 ' O ' ' OE2' ' A' ' 100' ' ' GLU . 99.1 mm-40 -63.17 -46.11 88.69 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 116.159 -0.473 . . . . 0.0 109.99 -179.894 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.804 HD21 ' HB2' ' B' ' 220' ' ' ALA . 9.0 mp -61.7 -43.52 98.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.133 -179.705 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 38.1 tp -65.47 -36.92 85.31 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.322 179.622 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . 0.548 ' CG ' HH21 ' A' ' 43' ' ' ARG . 94.7 m-20 -60.1 -45.5 92.75 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.113 -0.494 . . . . 0.0 109.895 -179.527 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.528 ' N ' ' OE1' ' A' ' 100' ' ' GLU . 0.4 OUTLIER -65.41 -53.24 45.95 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.284 -0.416 . . . . 0.0 109.997 179.586 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.751 ' HB2' HD21 ' B' ' 216' ' ' LEU . . . -53.24 -43.51 67.39 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.559 -0.456 . . . . 0.0 110.221 179.41 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 3.7 mm -60.59 -47.9 90.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 C-N-CA 120.369 -0.532 . . . . 0.0 110.516 -178.82 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -63.02 -40.12 96.81 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.391 -179.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . 0.443 ' ND1' ' CG ' ' B' ' 212' ' ' HIS . 81.3 t60 -60.21 -47.15 87.16 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.744 -179.65 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 11.0 t -74.34 -38.56 63.22 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.107 0.48 . . . . 0.0 111.222 179.76 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 81.9 tt0 -59.15 -39.09 81.32 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.793 -179.069 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 57.3 t-80 -53.74 -71.35 0.08 Allowed 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.215 -179.343 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.424 ' O ' ' O ' ' A' ' 109' ' ' HIS . 58.8 tp -96.48 97.22 9.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.946 0.403 . . . . 0.0 109.957 179.771 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . 0.424 ' O ' ' O ' ' A' ' 108' ' ' LEU . 86.9 m-70 -57.66 -155.13 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.472 179.847 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 86.8 mt -61.67 -42.42 98.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.784 -179.74 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 67.5 19.57 70.96 Favored Glycine 0 CA--C 1.519 0.303 0 N-CA-C 110.828 -0.909 . . . . 0.0 110.828 179.795 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 56.2 tp -101.48 84.74 2.64 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.839 0.352 . . . . 0.0 110.432 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 27.8 m -170.19 104.09 0.29 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.545 179.613 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 55.13 44.31 28.08 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.578 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 42.6 ttm180 -65.46 137.21 57.3 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.458 -179.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 70.5 m-70 -154.53 151.04 22.95 Favored Pre-proline 0 N--CA 1.452 -0.325 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.66 179.742 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_exo -44.98 -39.34 14.32 Favored 'Trans proline' 0 C--N 1.311 -1.414 0 C-N-CA 122.513 2.142 . . . . 0.0 112.246 179.518 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 62.2 m -60.72 -41.49 95.42 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.51 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . 53.56 45.48 28.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.6 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.729 0 CA-C-O 118.087 -1.396 . . . . 0.0 111.005 -179.956 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.314 0 N-CA-C 109.567 -1.413 . . . . 0.0 109.567 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 122' ' ' HIS . . . . . 0.431 ' O ' ' ND1' ' B' ' 122' ' ' HIS . 52.6 t-80 45.49 37.81 3.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.848 0.356 . . . . 0.0 110.599 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 123' ' ' GLY . . . . . . . . . . . . . . . -171.02 -179.09 41.98 Favored Glycine 0 CA--C 1.522 0.502 0 N-CA-C 110.776 -0.929 . . . . 0.0 110.776 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 35.9 m -119.67 131.44 72.19 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.293 0 CA-C-O 120.864 0.364 . . . . 0.0 110.532 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 125' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -61.69 -68.03 0.36 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.611 -179.804 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 147.66 145.95 4.26 Favored Glycine 0 CA--C 1.524 0.594 0 N-CA-C 110.826 -0.91 . . . . 0.0 110.826 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 127' ' ' ARG . . . . . . . . . . . . . 84.8 mtt85 -61.96 -43.07 99.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.707 0.289 . . . . 0.0 110.683 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 128' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 54.39 55.36 8.19 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.616 179.755 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 129' ' ' ARG . . . . . . . . . . . . . 83.6 mtm180 -66.5 147.71 98.87 Favored Pre-proline 0 N--CA 1.451 -0.377 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.673 -179.34 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -68.78 147.94 70.23 Favored 'Trans proline' 0 N--CA 1.494 1.519 0 C-N-CA 122.697 2.265 . . . . 0.0 111.941 179.658 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 45.3 t -107.54 98.66 8.24 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.312 179.28 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 132' ' ' ALA . . . . . . . . . . . . . . . -172.69 150.88 2.2 Favored Pre-proline 0 N--CA 1.449 -0.486 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.897 179.577 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 133' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -67.61 146.48 73.67 Favored 'Trans proline' 0 C--N 1.31 -1.47 0 C-N-CA 122.832 2.355 . . . . 0.0 111.675 179.439 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . 0.877 ' H ' HD23 ' B' ' 134' ' ' LEU . 1.2 pt? -108.94 2.63 21.52 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.736 179.873 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 135' ' ' ASP . . . . . 0.481 ' N ' ' OD1' ' B' ' 135' ' ' ASP . 26.5 p-10 -33.47 -47.08 0.21 Allowed 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 120.929 0.395 . . . . 0.0 110.841 -179.232 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . 0.445 ' N ' ' OD1' ' B' ' 135' ' ' ASP . 89.8 p -52.98 -50.59 63.84 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.293 179.098 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 137' ' ' GLN . . . . . 0.51 ' N ' ' O ' ' B' ' 134' ' ' LEU . 11.2 tp-100 -61.5 -44.22 97.47 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 109.851 -0.425 . . . . 0.0 109.851 179.786 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 138' ' ' ALA . . . . . 0.522 ' O ' HG23 ' B' ' 142' ' ' VAL . . . -58.14 -29.24 65.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.23 179.763 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -72.57 -52.45 15.48 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 121.032 0.444 . . . . 0.0 110.395 179.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -64.75 -40.25 94.98 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.95 179.823 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 59.0 tt0 -64.6 -53.18 51.78 Favored 'General case' 0 C--O 1.241 0.642 0 CA-C-O 121.349 0.595 . . . . 0.0 110.859 -179.6 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 142' ' ' VAL . . . . . 0.522 HG23 ' O ' ' B' ' 138' ' ' ALA . 96.8 t -62.76 -44.49 99.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.051 179.645 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -53.72 -43.97 69.46 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 179.717 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 14.8 t -57.99 -44.42 87.13 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 179.835 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 9.9 m -63.2 -45.64 90.74 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.102 178.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 96.2 mt -64.32 -22.56 66.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.524 179.583 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 147' ' ' GLN . . . . . 0.501 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 55.1 tt0 -75.02 -55.71 5.47 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.289 179.357 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -58.09 -55.58 33.16 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.371 -179.803 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.505 ' O ' ' O ' ' B' ' 150' ' ' ALA . 93.6 mt -45.41 -35.88 3.96 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.342 -179.557 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 150' ' ' ALA . . . . . 0.505 ' O ' ' O ' ' B' ' 149' ' ' LEU . . . -56.45 -139.76 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 O-C-N 123.56 0.537 . . . . 0.0 110.518 179.5 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 151' ' ' THR . . . . . 0.449 ' O ' ' O ' ' B' ' 150' ' ' ALA . 95.7 m 57.37 114.49 0.02 OUTLIER Pre-proline 0 C--N 1.323 -0.558 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.293 179.947 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -48.99 -47.76 20.52 Favored 'Trans proline' 0 N--CA 1.493 1.474 0 C-N-CA 122.292 1.995 . . . . 0.0 112.819 -179.042 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 67.9 m -61.91 -46.78 87.88 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.29 -179.022 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 3.2 tpp180 -62.61 -47.37 84.06 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.403 -178.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 155' ' ' LEU . . . . . 0.591 HD23 ' O ' ' B' ' 155' ' ' LEU . 2.7 tt -60.74 -52.96 62.88 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.43 -178.571 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 63.0 ttp -50.42 -48.06 56.33 Favored 'General case' 0 C--O 1.238 0.488 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.243 179.718 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 5.9 mm -62.71 -44.0 99.11 Favored 'Isoleucine or valine' 0 C--O 1.238 0.497 0 CA-C-O 121.019 0.437 . . . . 0.0 110.623 179.839 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 63.3 mt -61.73 -41.7 97.99 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.532 179.541 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 9.9 m -58.0 -40.05 79.8 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.71 179.572 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 160' ' ' GLN . . . . . 0.556 HE22 HD11 ' B' ' 175' ' ' ILE . 49.9 mt-30 -63.05 -44.35 96.08 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.826 -0.35 . . . . 0.0 110.421 179.417 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 161' ' ' LEU . . . . . 0.466 ' O ' ' N ' ' B' ' 163' ' ' ASN . 76.7 mt -62.83 -31.76 72.83 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.142 179.502 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 162' ' ' ARG . . . . . 0.524 HH21 ' CG ' ' B' ' 218' ' ' ASP . 33.4 tpt85 -34.58 -33.69 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 O-C-N 123.548 0.53 . . . . 0.0 110.959 -179.612 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 163' ' ' ASN . . . . . 0.466 ' N ' ' O ' ' B' ' 161' ' ' LEU . 86.9 m-20 -70.13 -83.0 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.293 179.671 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . 147.92 -76.05 0.26 Allowed Glycine 0 CA--C 1.525 0.675 0 N-CA-C 110.933 -0.867 . . . . 0.0 110.933 179.921 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -68.36 84.41 0.47 Allowed 'Trans proline' 0 N--CA 1.496 1.62 0 C-N-CA 122.71 2.274 . . . . 0.0 112.298 -179.721 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -157.02 66.72 3.99 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.101 0.477 . . . . 0.0 110.169 -179.552 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -44.51 171.36 0.02 OUTLIER 'Trans proline' 0 C--N 1.299 -2.053 0 C-N-CA 122.452 2.101 . . . . 0.0 112.143 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . 83.0 t -54.26 -46.57 68.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.324 -179.409 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 169' ' ' THR . . . . . . . . . . . . . 12.6 m -61.6 -37.81 85.29 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.274 0.559 . . . . 0.0 110.417 179.272 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -67.01 -40.55 87.32 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.133 179.78 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 171' ' ' LEU . . . . . 0.624 ' O ' HD13 ' B' ' 171' ' ' LEU . 0.2 OUTLIER -62.73 -42.07 99.49 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.9 -179.933 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 172' ' ' ALA . . . . . 0.575 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -56.54 -48.47 77.22 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 179.406 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -54.56 -43.95 72.48 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.013 179.592 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -56.95 -55.85 29.29 Favored 'General case' 0 C--O 1.232 0.154 0 C-N-CA 120.696 -0.402 . . . . 0.0 110.687 179.698 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 175' ' ' ILE . . . . . 0.556 HD11 HE22 ' B' ' 160' ' ' GLN . 89.7 mt -81.97 -68.66 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.299 179.497 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 176' ' ' GLY . . . . . 0.575 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 132.33 72.71 0.1 OUTLIER Glycine 0 CA--C 1.52 0.37 0 N-CA-C 110.962 -0.855 . . . . 0.0 110.962 179.742 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 177' ' ' MET . . . . . 0.474 ' CB ' ' O ' ' B' ' 176' ' ' GLY . 1.2 tmm? 79.86 96.47 0.06 Allowed 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 120.914 -0.314 . . . . 0.0 110.794 179.517 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -174.5 34.18 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.202 179.799 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -68.54 -23.29 64.51 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.899 -179.484 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 69.8 p -66.45 -44.88 81.6 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.055 -179.75 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -62.59 -34.99 78.11 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.382 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 97.9 t -66.98 -52.34 45.01 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.225 0 C-N-CA 120.602 -0.439 . . . . 0.0 110.509 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 50.0 m -55.21 -43.89 74.85 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.57 -0.452 . . . . 0.0 110.455 -179.684 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 184' ' ' HIS . . . . . 0.453 ' O ' HG22 ' B' ' 188' ' ' VAL . 77.7 m-70 -67.78 -42.91 80.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.034 179.756 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 69.7 mt-30 -62.74 -39.97 95.77 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.338 -179.848 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -67.93 -40.59 83.3 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 120.993 0.425 . . . . 0.0 110.592 178.871 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 187' ' ' ARG . . . . . 0.643 ' NH1' HD21 ' B' ' 191' ' ' ASN . 16.8 tpt85 -58.65 -46.31 87.41 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.712 -178.737 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 188' ' ' VAL . . . . . 0.595 HG23 ' N ' ' B' ' 189' ' ' LEU . 29.4 m -75.85 -52.59 17.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.537 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 189' ' ' LEU . . . . . 0.595 ' N ' HG23 ' B' ' 188' ' ' VAL . 72.1 mt -53.53 -39.91 65.07 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.161 -0.472 . . . . 0.0 109.746 -179.793 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 77.3 ttt180 -67.16 -43.18 82.93 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.453 179.038 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 191' ' ' ASN . . . . . 0.643 HD21 ' NH1' ' B' ' 187' ' ' ARG . 93.8 m-20 -59.35 -51.66 68.95 Favored 'General case' 0 C--O 1.23 0.071 0 C-N-CA 120.553 -0.459 . . . . 0.0 110.395 -179.407 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 192' ' ' LEU . . . . . 0.498 ' N ' HD22 ' B' ' 192' ' ' LEU . 4.1 mm? -68.12 -39.34 82.79 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.83 178.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 96.05 97.89 1.81 Allowed Glycine 0 CA--C 1.522 0.522 0 N-CA-C 110.915 -0.874 . . . . 0.0 110.915 -179.58 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 194' ' ' LEU . . . . . 0.414 ' H ' ' H ' ' B' ' 195' ' ' VAL . 4.2 tp -162.19 -9.0 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.904 0.383 . . . . 0.0 110.716 179.791 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 195' ' ' VAL . . . . . 0.414 ' H ' ' H ' ' B' ' 194' ' ' LEU . 34.4 m -139.42 161.65 27.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.382 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 196' ' ' VAL . . . . . 0.422 HG23 ' CD2' ' B' ' 209' ' ' TYR . 41.1 t -139.8 154.52 24.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 121.043 0.449 . . . . 0.0 110.473 179.892 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 197' ' ' GLY . . . . . 0.402 ' N ' ' CG1' ' B' ' 196' ' ' VAL . . . -143.21 153.09 24.56 Favored Glycine 0 CA--C 1.519 0.334 0 N-CA-C 111.002 -0.839 . . . . 0.0 111.002 179.505 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 198' ' ' ASP . . . . . 0.434 ' N ' ' OD1' ' B' ' 198' ' ' ASP . 5.8 p-10 -132.65 106.66 7.93 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.83 0.348 . . . . 0.0 110.456 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 61.6 ttp180 -84.87 132.12 34.43 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.642 179.787 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 200' ' ' ALA . . . . . . . . . . . . . . . -137.38 94.49 2.94 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.213 179.413 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 201' ' ' GLY . . . . . . . . . . . . . . . 64.66 -110.95 3.79 Favored Glycine 0 CA--C 1.521 0.463 0 N-CA-C 110.879 -0.889 . . . . 0.0 110.879 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 202' ' ' ARG . . . . . . . . . . . . . 41.0 mmm-85 -107.91 15.28 24.58 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 120.683 0.278 . . . . 0.0 110.526 -179.764 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 49.1 p -136.51 114.03 10.95 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-O 121.018 0.437 . . . . 0.0 110.53 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 204' ' ' ILE . . . . . 0.476 ' CD1' ' CD2' ' B' ' 206' ' ' TYR . 0.0 OUTLIER -116.07 154.94 17.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.308 179.635 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 58.8 t -129.18 123.55 58.61 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.187 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.686 178.738 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 206' ' ' TYR . . . . . 0.476 ' CD2' ' CD1' ' B' ' 204' ' ' ILE . 5.0 m-85 -107.24 129.81 54.82 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.655 179.207 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 49.2 m -150.59 168.56 23.9 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.361 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 208' ' ' LEU . . . . . 0.403 ' H ' ' HG ' ' B' ' 208' ' ' LEU . 18.1 mt -63.21 152.12 38.45 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.376 -179.65 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 209' ' ' TYR . . . . . 0.422 ' CD2' HG23 ' B' ' 196' ' ' VAL . 6.4 t80 -55.04 -48.71 73.07 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.368 -179.343 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 84.3 m-20 -132.88 177.84 7.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.936 0.398 . . . . 0.0 110.402 -179.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 211' ' ' THR . . . . . 0.625 ' O ' ' HB3' ' B' ' 214' ' ' ALA . 24.3 m -92.83 -20.02 21.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.457 -179.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 212' ' ' HIS . . . . . 0.443 ' CG ' ' ND1' ' A' ' 104' ' ' HIS . 83.7 m-70 -41.24 -65.44 0.43 Allowed 'General case' 0 C--O 1.237 0.429 0 CA-C-O 120.912 0.387 . . . . 0.0 110.557 179.876 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 22.8 m -47.88 -34.06 4.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.199 179.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 214' ' ' ALA . . . . . 0.625 ' HB3' ' O ' ' B' ' 211' ' ' THR . . . -65.04 -38.34 90.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.255 179.205 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 215' ' ' GLN . . . . . 0.412 ' O ' ' OE2' ' B' ' 219' ' ' GLU . 99.4 mm-40 -62.09 -46.99 86.64 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 121.056 0.455 . . . . 0.0 110.095 -179.908 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 216' ' ' LEU . . . . . 0.751 HD21 ' HB2' ' A' ' 101' ' ' ALA . 8.0 mp -61.01 -42.64 98.84 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.27 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 217' ' ' LEU . . . . . 0.402 HD12 ' HA ' ' B' ' 217' ' ' LEU . 45.7 tp -65.86 -37.34 85.93 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.383 179.523 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 218' ' ' ASP . . . . . 0.524 ' CG ' HH21 ' B' ' 162' ' ' ARG . 99.5 m-20 -59.9 -43.8 94.63 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.17 -0.468 . . . . 0.0 109.957 -179.469 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 219' ' ' GLU . . . . . 0.497 ' OE1' ' N ' ' B' ' 219' ' ' GLU . 0.6 OUTLIER -67.94 -52.12 39.74 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.15 179.344 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 220' ' ' ALA . . . . . 0.804 ' HB2' HD21 ' A' ' 97' ' ' LEU . . . -53.22 -44.22 67.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.166 179.477 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 4.9 mm -61.61 -45.9 97.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 C-N-CA 120.312 -0.555 . . . . 0.0 110.876 -179.34 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 4.8 m-85 -63.36 -39.82 95.57 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.499 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 223' ' ' HIS . . . . . 0.507 ' ND1' ' CG ' ' A' ' 93' ' ' HIS . 81.5 t60 -60.85 -46.77 89.28 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.728 -179.832 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 10.5 t -73.91 -39.81 63.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.156 179.65 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -56.94 -40.19 75.92 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.653 -179.252 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 53.2 t-80 -53.51 -71.37 0.07 Allowed 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 120.568 -0.453 . . . . 0.0 110.338 -179.181 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 227' ' ' LEU . . . . . 0.418 ' O ' ' O ' ' B' ' 228' ' ' HIS . 46.9 tp -96.96 98.17 9.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.977 0.418 . . . . 0.0 110.077 179.934 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 228' ' ' HIS . . . . . 0.418 ' O ' ' O ' ' B' ' 227' ' ' LEU . 89.4 m-70 -57.68 -155.23 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.482 179.725 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 229' ' ' LEU . . . . . . . . . . . . . 85.0 mt -62.21 -42.17 99.05 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.503 -179.851 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . 67.63 20.49 72.06 Favored Glycine 0 CA--C 1.518 0.252 0 N-CA-C 110.928 -0.869 . . . . 0.0 110.928 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 231' ' ' LEU . . . . . . . . . . . . . 56.7 tp -102.18 84.43 2.49 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.742 0.306 . . . . 0.0 110.46 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 232' ' ' SER . . . . . . . . . . . . . 47.5 m -170.46 105.61 0.29 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.614 179.586 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 233' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 54.17 42.9 31.32 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.547 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 234' ' ' ARG . . . . . . . . . . . . . 43.3 ttm180 -64.39 137.11 57.72 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.347 -179.717 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 235' ' ' HIS . . . . . . . . . . . . . 74.6 m-70 -154.22 150.67 22.78 Favored Pre-proline 0 CA--C 1.533 0.299 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.693 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 236' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_exo -44.28 -40.26 12.71 Favored 'Trans proline' 0 C--N 1.31 -1.465 0 C-N-CA 122.557 2.171 . . . . 0.0 112.246 179.281 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 237' ' ' SER . . . . . . . . . . . . . 69.8 m -60.16 -40.84 91.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.505 -179.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 238' ' ' ALA . . . . . . . . . . . . . . . 54.84 44.21 28.77 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.578 -179.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.702 0 CA-C-O 117.954 -1.47 . . . . 0.0 110.952 179.902 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.366 0 N-CA-C 109.517 -1.433 . . . . 0.0 109.517 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 77.8 m80 -153.47 67.69 0.78 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.792 0.329 . . . . 0.0 110.585 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 78.71 -169.74 54.41 Favored Glycine 0 CA--C 1.523 0.59 0 N-CA-C 111.04 -0.824 . . . . 0.0 111.04 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 97.6 t -63.25 -44.4 99.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 120.88 0.372 . . . . 0.0 110.71 -179.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 78.8 tt0 -132.21 147.72 52.43 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.511 -179.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -175.53 -161.68 25.39 Favored Glycine 0 CA--C 1.522 0.519 0 N-CA-C 110.728 -0.949 . . . . 0.0 110.728 -179.853 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 17.6 ptm180 -139.53 159.98 40.9 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.893 0.377 . . . . 0.0 110.52 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 36.9 p30 -151.6 167.66 27.41 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.395 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 7.8 mmp_? -142.56 75.38 18.91 Favored Pre-proline 0 N--CA 1.464 0.241 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.338 -179.847 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -58.42 143.63 97.52 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 C-N-CA 122.549 2.166 . . . . 0.0 112.123 179.695 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 63.1 m 52.98 87.66 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.516 179.76 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -175.02 74.27 0.3 Allowed Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.522 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -53.84 134.07 57.38 Favored 'Trans proline' 0 C--N 1.307 -1.658 0 C-N-CA 122.662 2.242 . . . . 0.0 111.831 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 67.8 mt -103.15 -133.32 0.3 Allowed 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.699 179.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 -97.81 -57.71 2.17 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.294 0.568 . . . . 0.0 110.994 179.54 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 93.4 p -58.77 -33.67 70.57 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.279 -179.424 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 54.3 mt-30 -68.59 -48.22 64.73 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.439 179.52 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.5 ' O ' HG23 ' A' ' 23' ' ' VAL . . . -55.68 -38.42 69.6 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 -179.81 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.64 -53.13 45.68 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 120.996 0.427 . . . . 0.0 110.259 179.606 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.98 -43.37 95.16 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 120.702 -0.399 . . . . 0.0 110.842 -179.859 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -64.17 -53.13 54.28 Favored 'General case' 0 C--O 1.242 0.665 0 CA-C-O 121.394 0.616 . . . . 0.0 111.045 -179.463 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.5 HG23 ' O ' ' A' ' 19' ' ' ALA . 96.0 t -61.73 -45.48 98.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.183 179.801 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.13 -41.3 83.39 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 179.853 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 45.6 t -57.08 -45.33 83.42 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 -179.724 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.428 ' OG1' ' O ' ' A' ' 23' ' ' VAL . 20.8 p -65.56 -44.68 86.02 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 120.755 -0.378 . . . . 0.0 110.497 178.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 96.1 mt -64.42 -23.72 67.38 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.661 179.482 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.51 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 57.0 tt0 -75.14 -57.38 3.93 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.54 179.543 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.26 -54.55 45.77 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 120.61 -0.436 . . . . 0.0 110.466 -179.417 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.489 ' O ' ' O ' ' A' ' 31' ' ' ALA . 88.7 mt -46.08 -34.62 4.27 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.27 -179.55 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.51 ' HB3' ' O ' ' A' ' 28' ' ' GLN . . . -57.03 -129.44 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 O-C-N 123.642 0.589 . . . . 0.0 110.364 179.437 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.467 ' HG1' ' HB2' ' A' ' 35' ' ' ARG . 0.3 OUTLIER 52.8 108.31 0.02 OUTLIER Pre-proline 0 CA--C 1.54 0.572 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.331 179.561 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_exo -45.8 -59.91 1.03 Allowed 'Trans proline' 0 C--N 1.309 -1.523 0 C-N-CA 122.166 1.91 . . . . 0.0 112.882 -179.217 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 50.8 m -54.86 -45.7 74.61 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.869 -178.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.467 ' HB2' ' HG1' ' A' ' 32' ' ' THR . 46.0 mmm-85 -61.79 -44.76 96.23 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.027 -179.582 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.594 HD23 ' O ' ' A' ' 36' ' ' LEU . 2.0 tt -63.11 -49.0 76.16 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.423 -179.342 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 28.6 ttt -52.1 -48.53 64.72 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.242 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.406 HG13 HE22 ' A' ' 66' ' ' GLN . 38.2 mm -63.63 -43.4 98.14 Favored 'Isoleucine or valine' 0 C--O 1.244 0.801 0 CA-C-O 121.189 0.519 . . . . 0.0 110.574 179.542 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 15.7 tp -61.76 -41.28 97.48 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.225 -179.55 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 19.6 m -61.27 -42.41 98.58 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 179.364 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 10.6 tp-100 -54.34 -48.06 71.84 Favored 'General case' 0 C--O 1.233 0.19 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 17.2 mt -64.29 -40.15 95.38 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.509 -0.476 . . . . 0.0 111.087 178.774 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.405 HH21 HD13 ' A' ' 98' ' ' LEU . 30.1 ttm180 -46.03 -25.51 0.58 Allowed 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.35 -179.186 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -61.59 -39.84 92.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.582 -179.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 157.66 -176.89 34.67 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.911 -0.876 . . . . 0.0 110.911 179.846 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -78.35 117.9 4.17 Favored 'Trans proline' 0 C--N 1.309 -1.501 0 C-N-CA 122.885 2.39 . . . . 0.0 111.67 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.541 HD12 ' O ' ' A' ' 47' ' ' LEU . 0.3 OUTLIER -148.75 128.25 6.39 Favored Pre-proline 0 CA--C 1.543 0.693 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.368 -179.58 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -47.53 167.28 0.09 OUTLIER 'Trans proline' 0 C--N 1.307 -1.613 0 C-N-CA 122.266 1.978 . . . . 0.0 112.475 178.745 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.424 ' CG2' ' N ' ' A' ' 50' ' ' THR . 2.4 m -61.06 -37.36 77.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-O 121.586 0.708 . . . . 0.0 110.518 179.91 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.424 ' N ' ' CG2' ' A' ' 49' ' ' VAL . 26.9 m -59.99 -44.93 94.19 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 115.029 -0.987 . . . . 0.0 110.386 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 55.4 m-20 -66.21 -39.33 89.55 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.122 178.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.652 HD23 ' O ' ' A' ' 52' ' ' LEU . 4.8 tt -61.55 -42.51 98.94 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.795 -179.886 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.563 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -60.75 -43.85 97.45 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 179.719 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -55.14 -44.79 75.4 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.63 -0.428 . . . . 0.0 109.878 179.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -62.53 -39.67 94.33 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.731 -0.388 . . . . 0.0 110.602 179.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.504 HD12 ' CD2' ' A' ' 52' ' ' LEU . 90.9 mt -94.38 -78.08 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.239 179.577 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . 0.563 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 150.11 83.55 0.04 OUTLIER Glycine 0 CA--C 1.521 0.408 0 N-CA-C 111.663 -0.575 . . . . 0.0 111.663 179.622 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.407 ' O ' ' OE1' ' A' ' 59' ' ' GLU . 87.1 mtp 57.49 103.32 0.02 OUTLIER 'General case' 0 CA--C 1.518 -0.283 0 CA-C-O 121.015 0.436 . . . . 0.0 111.047 179.008 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.407 ' OE1' ' O ' ' A' ' 58' ' ' MET . 3.6 tp10 -174.86 32.74 0.01 OUTLIER 'General case' 0 N--CA 1.456 -0.132 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.298 179.78 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 -63.1 -23.85 67.63 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.057 -178.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 78.0 p -71.06 -43.73 67.19 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.087 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.07 -29.7 70.82 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.174 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 92.4 t -74.45 -52.07 20.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 C-N-CA 120.809 -0.356 . . . . 0.0 110.615 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 67.9 p -56.03 -45.43 79.16 Favored 'General case' 0 C--O 1.233 0.192 0 C-N-CA 120.533 -0.467 . . . . 0.0 110.651 -179.77 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 73.6 m-70 -66.25 -50.9 62.17 Favored 'General case' 0 C--O 1.242 0.662 0 CA-C-O 121.171 0.51 . . . . 0.0 111.235 -179.866 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.406 HE22 HG13 ' A' ' 38' ' ' ILE . 79.9 mt-30 -58.34 -31.56 67.69 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.245 179.458 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.416 ' O ' ' CG ' ' A' ' 71' ' ' ARG . 5.1 tp -69.65 -43.39 72.71 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.446 179.931 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 82.3 mtp180 -60.19 -49.75 76.4 Favored 'General case' 0 C--O 1.245 0.843 0 CA-C-O 121.512 0.673 . . . . 0.0 111.167 -179.298 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.593 HG13 ' N ' ' A' ' 70' ' ' LEU . 4.4 p -66.2 -54.55 25.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.349 179.523 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.593 ' N ' HG13 ' A' ' 69' ' ' VAL . 70.8 mt -54.17 -35.23 62.07 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 -179.65 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.416 ' CG ' ' O ' ' A' ' 67' ' ' LEU . 11.9 mmm180 -61.78 -40.46 95.29 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.651 179.148 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -62.78 -42.97 99.93 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.075 -179.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.485 HD23 ' N ' ' A' ' 73' ' ' LEU . 6.9 mt -67.61 -42.34 82.57 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.422 -179.496 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 100.9 37.54 3.63 Favored Glycine 0 CA--C 1.522 0.483 0 N-CA-C 111.22 -0.752 . . . . 0.0 111.22 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -100.43 -15.37 17.95 Favored 'General case' 0 CA--C 1.512 -0.483 0 O-C-N 122.825 -0.221 . . . . 0.0 110.897 179.534 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 23.2 m -136.57 158.58 37.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-O 120.846 0.355 . . . . 0.0 110.049 -179.815 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.432 ' CG1' ' N ' ' A' ' 78' ' ' GLY . 40.1 t -142.48 156.53 18.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.622 179.836 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.432 ' N ' ' CG1' ' A' ' 77' ' ' VAL . . . -105.13 167.68 15.18 Favored Glycine 0 CA--C 1.522 0.524 0 N-CA-C 110.309 -1.116 . . . . 0.0 110.309 179.555 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 68.0 t0 -146.05 122.38 10.93 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.602 0.239 . . . . 0.0 110.568 -179.374 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 77.1 mtp85 -77.12 163.49 26.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.887 179.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.463 ' O ' ' N ' ' A' ' 83' ' ' ARG . . . -166.98 107.95 0.64 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.753 -179.905 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 53.56 -87.88 0.01 OUTLIER Glycine 0 CA--C 1.522 0.508 0 N-CA-C 110.707 -0.957 . . . . 0.0 110.707 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.463 ' N ' ' O ' ' A' ' 81' ' ' ALA . 50.7 ttt85 -136.61 42.75 2.48 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 121.064 0.459 . . . . 0.0 110.089 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 87.7 p -163.65 162.17 24.06 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.793 0.33 . . . . 0.0 110.26 179.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.628 HD11 ' CZ ' ' A' ' 87' ' ' TYR . 1.2 pp -134.25 155.59 39.47 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-O 120.88 0.372 . . . . 0.0 110.345 179.578 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.419 ' N ' HD12 ' A' ' 85' ' ' ILE . 18.6 t -133.23 156.74 42.3 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.262 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.403 178.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.628 ' CZ ' HD11 ' A' ' 85' ' ' ILE . 44.2 m-85 -106.0 136.64 45.3 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.532 -179.496 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 94.8 p -151.91 172.7 15.82 Favored 'General case' 0 C--O 1.224 -0.289 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.423 -179.798 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 56.3 mt -65.41 148.2 52.12 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.656 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.413 ' CD2' HG23 ' A' ' 77' ' ' VAL . 10.2 t80 -52.71 -48.5 66.59 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.312 -179.456 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.486 ' OD2' ' CD2' ' B' ' 227' ' ' LEU . 46.5 p-10 -146.77 -179.78 7.03 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.781 0.324 . . . . 0.0 110.555 -179.857 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . 0.453 ' O ' ' HB3' ' A' ' 95' ' ' ALA . 42.0 p -88.7 -16.34 32.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.558 -179.844 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 58.4 m80 -46.88 -65.38 0.57 Allowed 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.048 0.452 . . . . 0.0 110.697 -179.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 11.9 p -52.79 -35.25 21.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.193 -179.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.453 ' HB3' ' O ' ' A' ' 92' ' ' THR . . . -62.97 -40.35 97.44 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.411 179.493 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -63.55 -44.45 94.12 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 116.013 -0.54 . . . . 0.0 109.895 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 13.9 tp -60.02 -42.71 94.94 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.158 -179.835 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.405 HD13 HH21 ' A' ' 43' ' ' ARG . 87.5 mt -63.39 -39.2 93.87 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.154 179.801 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -60.28 -42.86 96.33 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.103 -179.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 73.8 mm-40 -67.72 -47.69 68.64 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.542 179.617 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.14 -44.29 92.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.262 -0.426 . . . . 0.0 109.949 179.684 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 5.0 mm -62.94 -44.13 99.43 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.639 -179.561 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -60.08 -42.19 94.07 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.998 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 35.0 m170 -68.77 -35.96 77.72 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.245 179.788 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 7.0 t -59.02 -47.98 83.25 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.322 -179.692 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -74.8 -57.28 4.01 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.003 0.43 . . . . 0.0 110.431 179.465 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 53.3 m170 -52.32 -37.65 56.43 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.043 -179.867 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.501 ' CD2' ' OD2' ' B' ' 210' ' ' ASP . 39.1 tp -135.53 104.44 5.82 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.398 179.36 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . 0.446 ' O ' ' CG ' ' A' ' 109' ' ' HIS . 49.0 p-80 -116.19 105.46 12.6 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.866 179.636 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.558 ' N ' HD12 ' A' ' 110' ' ' LEU . 9.8 mp -64.13 -42.05 96.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.306 179.768 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 82.95 58.41 2.35 Favored Glycine 0 CA--C 1.521 0.444 0 N-CA-C 110.935 -0.866 . . . . 0.0 110.935 -179.743 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 55.8 tp -96.94 135.02 39.52 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.902 0.382 . . . . 0.0 110.531 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 47.3 t -63.54 145.25 56.04 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.648 179.651 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -81.29 -3.62 53.07 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.604 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 53.7 ptt85 -139.36 156.02 47.28 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.575 -179.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . 0.54 ' N ' ' HD2' ' A' ' 117' ' ' PRO . 0.4 OUTLIER 178.7 -58.91 0.0 OUTLIER Pre-proline 0 C--N 1.321 -0.644 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.943 -179.354 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . 0.54 ' HD2' ' N ' ' A' ' 116' ' ' HIS . 24.3 Cg_endo -60.64 -25.5 81.0 Favored 'Trans proline' 0 N--CA 1.491 1.339 0 C-N-CA 122.57 2.18 . . . . 0.0 111.738 -179.184 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 34.4 t -64.99 140.73 58.9 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.598 -179.673 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -162.4 -36.38 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.618 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.219 -0.789 0 CA-C-O 118.035 -1.425 . . . . 0.0 110.945 -179.958 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.354 0 N-CA-C 109.494 -1.442 . . . . 0.0 109.494 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 79.0 m80 -149.37 67.92 1.03 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.811 0.338 . . . . 0.0 110.522 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 123' ' ' GLY . . . . . . . . . . . . . . . 79.21 -169.42 53.88 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 111.006 -0.837 . . . . 0.0 111.006 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 90.5 t -63.32 -44.41 99.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 120.872 0.367 . . . . 0.0 110.768 179.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 125' ' ' GLU . . . . . . . . . . . . . 85.0 tt0 -133.15 147.21 52.08 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.556 -179.858 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -174.91 -161.05 23.98 Favored Glycine 0 CA--C 1.522 0.528 0 N-CA-C 110.792 -0.923 . . . . 0.0 110.792 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 127' ' ' ARG . . . . . . . . . . . . . 17.6 ptm180 -139.21 159.74 41.43 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.826 0.346 . . . . 0.0 110.482 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 128' ' ' ASN . . . . . . . . . . . . . 40.3 p30 -150.14 167.84 25.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.54 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 129' ' ' ARG . . . . . . . . . . . . . 7.8 mmp_? -144.05 74.74 15.99 Favored Pre-proline 0 C--N 1.331 -0.213 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.386 -179.801 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo -58.6 144.72 97.17 Favored 'Trans proline' 0 C--N 1.305 -1.743 0 C-N-CA 122.517 2.145 . . . . 0.0 112.146 179.617 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 50.3 m 55.86 83.78 0.09 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.465 179.83 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 132' ' ' ALA . . . . . . . . . . . . . . . -172.5 74.27 0.44 Allowed Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.246 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 133' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_exo -54.47 135.37 65.83 Favored 'Trans proline' 0 C--N 1.307 -1.642 0 C-N-CA 122.686 2.257 . . . . 0.0 111.977 -179.59 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . 0.53 ' O ' ' N ' ' B' ' 137' ' ' GLN . 58.7 mt -113.95 154.45 27.56 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.017 179.546 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 135' ' ' ASP . . . . . 0.438 ' C ' ' O ' ' B' ' 134' ' ' LEU . 98.0 m-20 -32.55 -48.78 0.2 Allowed 'General case' 0 N--CA 1.466 0.37 0 O-C-N 123.544 0.528 . . . . 0.0 110.591 -179.091 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 11.2 t -59.14 -48.79 80.32 Favored 'General case' 0 C--O 1.24 0.585 0 CA-C-O 121.189 0.519 . . . . 0.0 110.711 178.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 137' ' ' GLN . . . . . 0.53 ' N ' ' O ' ' B' ' 134' ' ' LEU . 73.8 mt-30 -64.53 -42.78 95.55 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.948 -179.881 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 138' ' ' ALA . . . . . 0.492 ' O ' HG23 ' B' ' 142' ' ' VAL . . . -55.83 -38.86 70.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.08 -179.891 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -65.36 -53.25 46.25 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 120.933 0.396 . . . . 0.0 110.242 179.552 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -60.52 -41.85 95.22 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.532 -0.467 . . . . 0.0 110.879 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 59.5 tt0 -64.35 -53.71 44.43 Favored 'General case' 0 C--O 1.244 0.773 0 CA-C-O 121.415 0.626 . . . . 0.0 111.025 -179.573 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 142' ' ' VAL . . . . . 0.492 HG23 ' O ' ' B' ' 138' ' ' ALA . 89.4 t -62.17 -45.68 98.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.006 179.684 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -57.27 -42.09 80.97 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 44.2 t -56.58 -45.84 81.11 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 -179.725 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 145' ' ' THR . . . . . 0.458 ' OG1' ' O ' ' B' ' 142' ' ' VAL . 21.7 p -65.16 -44.02 89.89 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 120.65 -0.42 . . . . 0.0 110.54 179.078 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 95.9 mt -64.37 -24.05 67.5 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.598 179.455 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 147' ' ' GLN . . . . . 0.506 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 55.9 tt0 -75.38 -57.05 4.13 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.536 179.607 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -57.95 -54.67 44.32 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.599 -179.32 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.501 ' O ' ' O ' ' B' ' 150' ' ' ALA . 92.9 mt -46.29 -35.56 5.43 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.319 -179.66 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 150' ' ' ALA . . . . . 0.506 ' HB3' ' O ' ' B' ' 147' ' ' GLN . . . -56.69 -131.43 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.262 0.553 . . . . 0.0 110.407 179.6 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 151' ' ' THR . . . . . 0.532 ' HG1' ' HB2' ' B' ' 154' ' ' ARG . 0.4 OUTLIER 54.61 108.61 0.02 OUTLIER Pre-proline 0 CA--C 1.539 0.539 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.322 179.503 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -45.58 -61.45 0.59 Allowed 'Trans proline' 0 C--N 1.31 -1.494 0 C-N-CA 122.304 2.003 . . . . 0.0 112.868 -179.11 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 49.6 m -53.96 -46.7 71.69 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.0 -178.591 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 154' ' ' ARG . . . . . 0.532 ' HB2' ' HG1' ' B' ' 151' ' ' THR . 46.0 mmm-85 -60.46 -44.09 96.23 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 120.716 -0.394 . . . . 0.0 111.011 -179.502 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 155' ' ' LEU . . . . . 0.59 HD23 ' O ' ' B' ' 155' ' ' LEU . 1.9 tt -64.18 -49.16 73.14 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.31 -179.389 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 28.6 ttt -51.61 -49.05 62.93 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.241 -179.459 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 42.8 mm -64.24 -43.69 97.3 Favored 'Isoleucine or valine' 0 C--O 1.247 0.931 0 CA-C-O 121.188 0.518 . . . . 0.0 110.437 179.737 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 17.6 tp -60.84 -42.1 97.11 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.262 -179.516 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 19.0 m -61.57 -41.59 97.62 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.858 179.383 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 10.4 tp-100 -53.45 -49.29 67.7 Favored 'General case' 0 C--O 1.233 0.202 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 161' ' ' LEU . . . . . 0.464 ' O ' ' N ' ' B' ' 163' ' ' ASN . 8.9 mt -64.29 -40.65 96.39 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.288 -0.565 . . . . 0.0 111.153 179.054 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 162' ' ' ARG . . . . . 0.462 HH21 HD13 ' B' ' 217' ' ' LEU . 32.6 ttm180 -42.14 -23.56 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.287 -179.213 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 163' ' ' ASN . . . . . 0.464 ' N ' ' O ' ' B' ' 161' ' ' LEU . 7.7 m120 -63.06 -41.46 99.46 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.624 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 164' ' ' GLY . . . . . 0.401 ' N ' ' O ' ' B' ' 161' ' ' LEU . . . 155.83 -170.36 33.65 Favored Glycine 0 CA--C 1.522 0.484 0 N-CA-C 111.09 -0.804 . . . . 0.0 111.09 179.523 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -74.24 120.27 6.2 Favored 'Trans proline' 0 N--CA 1.495 1.594 0 C-N-CA 122.916 2.411 . . . . 0.0 111.849 179.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 166' ' ' LEU . . . . . 0.5 ' O ' HD12 ' B' ' 166' ' ' LEU . 0.2 OUTLIER -151.92 120.91 3.39 Favored Pre-proline 0 CA--C 1.545 0.768 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.633 179.843 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -47.6 168.67 0.07 OUTLIER 'Trans proline' 0 C--N 1.304 -1.788 0 C-N-CA 122.26 1.974 . . . . 0.0 112.317 178.633 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 168' ' ' VAL . . . . . 0.438 HG13 ' H ' ' B' ' 168' ' ' VAL . 2.6 m -60.46 -37.75 75.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-O 121.698 0.761 . . . . 0.0 110.41 179.875 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 169' ' ' THR . . . . . 0.42 ' N ' ' CG2' ' B' ' 168' ' ' VAL . 14.0 m -60.7 -45.65 93.37 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 115.058 -0.973 . . . . 0.0 110.192 -179.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 71.5 m-20 -65.11 -41.15 95.17 Favored 'General case' 0 C--O 1.241 0.639 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.077 179.314 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 171' ' ' LEU . . . . . 0.59 HD23 ' O ' ' B' ' 171' ' ' LEU . 4.5 tt -61.32 -41.71 97.46 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.936 -179.541 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 172' ' ' ALA . . . . . 0.549 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -60.77 -44.03 97.28 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 179.649 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -55.26 -44.52 75.66 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.275 -0.42 . . . . 0.0 109.897 179.773 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -61.92 -41.04 97.47 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.47 179.623 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 175' ' ' ILE . . . . . 0.482 HD12 ' CD2' ' B' ' 171' ' ' LEU . 96.7 mt -93.52 -79.04 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.183 179.486 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 176' ' ' GLY . . . . . 0.549 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 151.84 82.43 0.04 OUTLIER Glycine 0 CA--C 1.52 0.388 0 N-CA-C 111.518 -0.633 . . . . 0.0 111.518 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 177' ' ' MET . . . . . 0.435 ' O ' ' OE1' ' B' ' 178' ' ' GLU . 89.0 mtp 58.34 105.37 0.02 OUTLIER 'General case' 0 CA--C 1.518 -0.253 0 CA-C-O 120.853 0.359 . . . . 0.0 110.995 179.076 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 178' ' ' GLU . . . . . 0.435 ' OE1' ' O ' ' B' ' 177' ' ' MET . 4.0 tp10 -176.87 32.75 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.28 179.75 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 7.5 mt-30 -62.84 -23.8 67.46 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.031 -179.005 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 78.7 p -70.95 -42.45 69.79 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.968 -179.697 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -65.71 -28.91 69.4 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.299 -179.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 97.9 t -74.8 -52.47 19.14 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.126 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.547 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 79.4 p -56.32 -43.8 79.34 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 120.541 -0.464 . . . . 0.0 110.366 -179.699 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 64.5 m-70 -66.84 -50.93 60.99 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-O 121.163 0.506 . . . . 0.0 111.078 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -58.8 -31.48 68.46 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.214 179.507 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 186' ' ' LEU . . . . . 0.415 ' O ' ' CG ' ' B' ' 190' ' ' ARG . 5.1 tp -69.77 -43.46 72.15 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.549 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 81.3 mtp180 -60.02 -49.17 78.71 Favored 'General case' 0 C--O 1.246 0.876 0 CA-C-O 121.293 0.568 . . . . 0.0 111.144 -179.376 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 188' ' ' VAL . . . . . 0.588 HG13 ' N ' ' B' ' 189' ' ' LEU . 4.9 p -67.05 -54.39 24.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.243 179.726 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 189' ' ' LEU . . . . . 0.588 ' N ' HG13 ' B' ' 188' ' ' VAL . 73.4 mt -54.21 -35.63 62.6 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 -179.657 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 190' ' ' ARG . . . . . 0.415 ' CG ' ' O ' ' B' ' 186' ' ' LEU . 12.6 mmm180 -61.36 -40.56 94.76 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.63 179.12 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -62.92 -42.58 99.85 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 120.37 -0.532 . . . . 0.0 109.969 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 192' ' ' LEU . . . . . 0.494 HD23 ' N ' ' B' ' 192' ' ' LEU . 7.2 mt -67.91 -38.29 82.78 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.42 -179.542 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 95.9 35.28 5.64 Favored Glycine 0 CA--C 1.521 0.427 0 N-CA-C 111.23 -0.748 . . . . 0.0 111.23 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -98.4 -15.89 19.5 Favored 'General case' 0 CA--C 1.512 -0.511 0 O-C-N 122.916 -0.167 . . . . 0.0 111.079 179.558 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 26.5 m -136.4 158.44 37.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.11 -179.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 196' ' ' VAL . . . . . 0.44 ' CG1' ' N ' ' B' ' 197' ' ' GLY . 41.2 t -142.77 156.76 18.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.595 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 197' ' ' GLY . . . . . 0.44 ' N ' ' CG1' ' B' ' 196' ' ' VAL . . . -106.08 168.69 15.13 Favored Glycine 0 CA--C 1.523 0.572 0 N-CA-C 110.418 -1.073 . . . . 0.0 110.418 179.6 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 67.9 t0 -146.38 122.76 10.98 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.769 0.319 . . . . 0.0 110.559 -179.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 77.7 mtp85 -76.86 163.07 27.11 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.842 179.618 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 200' ' ' ALA . . . . . 0.43 ' O ' ' N ' ' B' ' 202' ' ' ARG . . . -167.15 108.87 0.65 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.588 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 201' ' ' GLY . . . . . . . . . . . . . . . 53.75 -89.54 0.01 OUTLIER Glycine 0 CA--C 1.522 0.528 0 N-CA-C 110.709 -0.956 . . . . 0.0 110.709 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 202' ' ' ARG . . . . . 0.43 ' N ' ' O ' ' B' ' 200' ' ' ALA . 52.4 ttt85 -135.56 42.08 2.7 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 121.149 0.5 . . . . 0.0 110.07 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 84.5 p -162.78 162.97 26.88 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.872 0.368 . . . . 0.0 110.138 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 204' ' ' ILE . . . . . 0.638 HD11 ' CZ ' ' B' ' 206' ' ' TYR . 1.2 pp -133.83 156.71 41.53 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.423 179.701 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 205' ' ' VAL . . . . . 0.448 HG12 ' N ' ' B' ' 206' ' ' TYR . 21.4 t -132.93 158.43 43.27 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.391 178.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 206' ' ' TYR . . . . . 0.638 ' CZ ' HD11 ' B' ' 204' ' ' ILE . 45.0 m-85 -108.77 135.5 49.89 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.332 -179.668 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 83.5 p -151.56 172.06 16.62 Favored 'General case' 0 C--O 1.224 -0.289 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.429 -179.759 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . 55.3 mt -65.63 149.12 50.61 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.529 -179.764 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 209' ' ' TYR . . . . . 0.418 ' CD2' HG23 ' B' ' 196' ' ' VAL . 11.7 t80 -52.44 -48.72 65.61 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.326 -179.631 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 210' ' ' ASP . . . . . 0.501 ' OD2' ' CD2' ' A' ' 108' ' ' LEU . 42.5 p-10 -146.74 -178.94 6.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.77 0.319 . . . . 0.0 110.559 179.982 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 211' ' ' THR . . . . . 0.476 ' O ' ' HB3' ' B' ' 214' ' ' ALA . 30.7 p -88.97 -17.04 30.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.374 -179.755 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 212' ' ' HIS . . . . . . . . . . . . . 46.3 m80 -45.12 -65.21 0.56 Allowed 'General case' 0 C--O 1.237 0.419 0 CA-C-O 121.045 0.45 . . . . 0.0 110.701 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 10.7 p -53.05 -35.64 23.05 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.178 -179.823 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 214' ' ' ALA . . . . . 0.476 ' HB3' ' O ' ' B' ' 211' ' ' THR . . . -62.09 -41.96 98.73 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.392 179.55 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -62.51 -45.12 94.43 Favored 'General case' 0 C--O 1.238 0.459 0 CA-C-N 116.172 -0.467 . . . . 0.0 109.894 -179.917 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 216' ' ' LEU . . . . . . . . . . . . . 18.4 tp -60.01 -42.38 94.16 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.06 -179.648 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 217' ' ' LEU . . . . . 0.462 HD13 HH21 ' B' ' 162' ' ' ARG . 79.1 mt -63.72 -39.76 95.1 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.306 179.745 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 97.0 m-20 -59.66 -42.91 93.89 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.176 -179.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 219' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -67.16 -49.11 65.89 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.779 -0.368 . . . . 0.0 110.634 179.446 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -57.69 -44.99 86.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.285 -0.416 . . . . 0.0 109.924 179.689 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 4.8 mm -62.34 -43.98 98.7 Favored 'Isoleucine or valine' 0 C--O 1.237 0.442 0 CA-C-O 121.148 0.499 . . . . 0.0 110.612 -179.457 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -60.68 -42.22 96.66 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.937 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 223' ' ' HIS . . . . . . . . . . . . . 46.7 m170 -68.88 -36.3 77.91 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.113 179.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 43.0 t -58.73 -47.71 83.65 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.262 -179.673 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -74.9 -57.22 4.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.993 0.425 . . . . 0.0 110.586 179.236 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 59.2 m170 -52.53 -36.98 56.65 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.125 -179.809 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 227' ' ' LEU . . . . . 0.486 ' CD2' ' OD2' ' A' ' 91' ' ' ASP . 44.6 tp -136.36 104.25 5.55 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.499 179.371 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 228' ' ' HIS . . . . . 0.432 ' O ' ' CG ' ' B' ' 228' ' ' HIS . 48.0 p-80 -116.05 106.6 13.94 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 121.019 0.438 . . . . 0.0 110.766 179.46 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 229' ' ' LEU . . . . . 0.536 ' N ' HD12 ' B' ' 229' ' ' LEU . 10.4 mp -63.94 -41.23 97.67 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.415 179.747 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . 82.62 57.96 2.49 Favored Glycine 0 CA--C 1.521 0.415 0 N-CA-C 110.855 -0.898 . . . . 0.0 110.855 -179.624 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 231' ' ' LEU . . . . . . . . . . . . . 57.5 tp -97.37 137.77 35.84 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.785 0.326 . . . . 0.0 110.59 -179.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 232' ' ' SER . . . . . . . . . . . . . 41.1 t -66.82 146.08 54.8 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.559 179.46 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 233' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -81.65 -6.17 58.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.779 179.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 234' ' ' ARG . . . . . . . . . . . . . 53.5 ptt85 -136.36 156.9 47.97 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.966 0.413 . . . . 0.0 110.478 -179.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 235' ' ' HIS . . . . . 0.539 ' N ' ' HD2' ' B' ' 236' ' ' PRO . 0.4 OUTLIER 177.59 -58.63 0.0 OUTLIER Pre-proline 0 C--N 1.322 -0.621 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.862 -179.377 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 236' ' ' PRO . . . . . 0.539 ' HD2' ' N ' ' B' ' 235' ' ' HIS . 22.9 Cg_endo -60.45 -26.71 83.37 Favored 'Trans proline' 0 N--CA 1.492 1.439 0 C-N-CA 122.448 2.099 . . . . 0.0 111.664 -179.076 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 237' ' ' SER . . . . . . . . . . . . . 48.4 t -63.7 142.46 58.39 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.427 -179.52 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 238' ' ' ALA . . . . . . . . . . . . . . . -163.87 -33.22 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.598 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.778 0 CA-C-O 117.992 -1.449 . . . . 0.0 110.902 -179.928 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.258 0 N-CA-C 109.505 -1.438 . . . . 0.0 109.505 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 74.4 m80 -60.84 -41.42 95.8 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.84 0.352 . . . . 0.0 110.473 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . 0.426 ' O ' ' O ' ' A' ' 5' ' ' VAL . . . 74.49 -169.72 54.04 Favored Glycine 0 CA--C 1.524 0.652 0 N-CA-C 110.946 -0.862 . . . . 0.0 110.946 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.426 ' O ' ' O ' ' A' ' 4' ' ' GLY . 5.6 t 56.82 113.19 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 120.86 0.362 . . . . 0.0 110.527 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -122.34 124.85 44.66 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.536 179.881 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 51.32 80.28 0.07 OUTLIER Glycine 0 CA--C 1.523 0.587 0 N-CA-C 110.931 -0.868 . . . . 0.0 110.931 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 63.1 ttm-85 -61.17 -44.32 97.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.814 0.34 . . . . 0.0 110.548 -179.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.424 ' O ' ' OD1' ' A' ' 9' ' ' ASN . 45.0 p-10 -155.22 125.02 6.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.591 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.499 ' N ' ' CD ' ' A' ' 11' ' ' PRO . 24.6 ttm180 -168.35 50.6 0.19 Allowed Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.547 179.692 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.499 ' CD ' ' N ' ' A' ' 10' ' ' ARG . 36.5 Cg_endo -64.7 143.95 82.43 Favored 'Trans proline' 0 C--N 1.307 -1.637 0 C-N-CA 122.828 2.352 . . . . 0.0 111.924 179.849 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 20.8 p -83.1 139.61 33.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.358 179.602 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -178.74 149.4 0.62 Allowed Pre-proline 0 N--CA 1.449 -0.499 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.727 179.507 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -69.04 106.87 1.6 Allowed 'Trans proline' 0 N--CA 1.495 1.613 0 C-N-CA 122.476 2.117 . . . . 0.0 111.95 179.361 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 23.5 mt -92.36 122.16 34.55 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.151 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 95.0 m-20 -95.78 -53.02 3.85 Favored 'General case' 0 C--O 1.239 0.55 0 CA-C-O 121.258 0.552 . . . . 0.0 110.802 179.677 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 37.7 t -57.55 -42.75 83.57 Favored 'General case' 0 C--O 1.239 0.547 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.124 -179.552 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 9.1 mm100 -66.49 -42.66 87.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.28 179.521 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.527 ' O ' HG23 ' A' ' 23' ' ' VAL . . . -51.74 -48.11 63.77 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 -179.209 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.34 -53.98 49.69 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 120.387 -0.525 . . . . 0.0 110.308 179.07 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -52.6 -48.24 66.41 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.03 179.803 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 85.8 mm-40 -56.32 -50.03 72.61 Favored 'General case' 0 C--O 1.241 0.614 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.688 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.527 HG23 ' O ' ' A' ' 19' ' ' ALA . 84.2 t -60.12 -37.66 73.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.813 179.686 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.682 ' HB2' HD12 ' B' ' 155' ' ' LEU . . . -64.86 -42.07 95.16 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.411 178.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 67.1 m -56.9 -49.69 74.8 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.935 0.398 . . . . 0.0 110.99 -178.693 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.414 HG23 ' N ' ' A' ' 27' ' ' LEU . 1.4 t -65.65 -48.68 71.32 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.725 179.832 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.414 ' N ' HG23 ' A' ' 26' ' ' THR . 69.1 mt -62.01 -26.06 68.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.946 179.758 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.667 ' NE2' ' NE2' ' B' ' 147' ' ' GLN . 29.6 tp60 -72.88 -60.12 2.38 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.352 179.224 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -55.64 -53.97 49.9 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.714 -179.189 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.511 ' O ' ' O ' ' A' ' 31' ' ' ALA . 7.3 mp -46.56 -35.45 5.83 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.397 -179.192 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.511 ' O ' ' O ' ' A' ' 30' ' ' LEU . . . -57.47 -132.69 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.45 0 O-C-N 123.52 0.512 . . . . 0.0 110.022 179.468 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.47 ' O ' ' O ' ' A' ' 31' ' ' ALA . 0.8 OUTLIER 54.43 113.04 0.01 OUTLIER Pre-proline 0 CA--C 1.542 0.661 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.39 179.495 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -50.45 -57.58 2.2 Favored 'Trans proline' 0 N--CA 1.495 1.609 0 C-N-CA 122.283 1.989 . . . . 0.0 113.282 -179.541 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 80.5 p -52.8 -46.09 67.52 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.22 -178.175 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 10.7 mpt_? -61.97 -42.67 99.4 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.637 -179.61 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.697 HD12 ' HB2' ' B' ' 143' ' ' ALA . 5.1 mt -61.37 -51.92 66.8 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 120.35 -0.54 . . . . 0.0 110.841 -179.159 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 11.2 tpt -53.83 -49.35 68.59 Favored 'General case' 0 C--O 1.24 0.574 0 C-N-CA 120.279 -0.568 . . . . 0.0 110.224 -179.62 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 96.7 mt -62.88 -45.58 98.5 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 CA-C-O 121.568 0.699 . . . . 0.0 110.405 -179.596 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 53.5 mt -62.21 -38.12 87.94 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.721 179.504 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 18.0 m -59.41 -41.8 90.3 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.996 179.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.853 HE22 HD11 ' A' ' 52' ' ' LEU . 0.0 OUTLIER -57.99 -43.82 86.8 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.282 -0.567 . . . . 0.0 110.269 179.839 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.587 ' N ' ' HG2' ' A' ' 41' ' ' GLN . 15.0 mt -64.19 -38.17 90.1 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.323 -179.411 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 73.6 ttp85 -51.0 -39.22 55.18 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.477 -179.402 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 51.4 t-20 -56.25 -39.55 72.77 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.411 -179.313 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 153.06 175.02 24.05 Favored Glycine 0 CA--C 1.524 0.595 0 N-CA-C 111.016 -0.834 . . . . 0.0 111.016 179.73 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -70.25 142.04 44.76 Favored 'Trans proline' 0 C--N 1.308 -1.6 0 C-N-CA 122.694 2.263 . . . . 0.0 111.764 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.519 HD12 ' O ' ' A' ' 47' ' ' LEU . 0.3 OUTLIER -162.81 160.62 19.44 Favored Pre-proline 0 C--N 1.326 -0.441 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.684 -179.838 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -63.26 142.01 84.47 Favored 'Trans proline' 0 N--CA 1.495 1.565 0 C-N-CA 122.519 2.146 . . . . 0.0 112.341 179.086 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 46.6 t -62.28 -43.16 97.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.423 179.457 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 89.6 m -55.86 -69.28 0.15 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.825 -179.317 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 63.1 t0 -52.23 -40.67 61.93 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.226 0.536 . . . . 0.0 109.719 -179.33 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.853 HD11 HE22 ' A' ' 41' ' ' GLN . 2.9 tm? -59.02 -48.22 82.38 Favored 'General case' 0 C--N 1.316 -0.875 0 C-N-CA 119.732 -0.787 . . . . 0.0 110.336 -179.451 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.578 ' O ' ' N ' ' A' ' 58' ' ' MET . . . -56.34 -39.23 72.49 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.358 0.599 . . . . 0.0 110.315 -179.333 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -65.04 -28.8 69.73 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.592 179.476 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.401 ' HB3' ' O ' ' A' ' 52' ' ' LEU . . . -63.28 -43.42 97.98 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.923 179.928 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.43 HG23 ' N ' ' A' ' 57' ' ' GLY . 8.5 tt -164.14 -36.06 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.921 -179.556 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . 0.43 ' N ' HG23 ' A' ' 56' ' ' ILE . . . -54.74 -71.47 0.71 Allowed Glycine 0 CA--C 1.522 0.515 0 N-CA-C 111.205 -0.758 . . . . 0.0 111.205 -178.197 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.578 ' N ' ' O ' ' A' ' 53' ' ' ALA . 0.1 OUTLIER 64.64 27.21 13.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.678 0.275 . . . . 0.0 110.345 179.749 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -153.76 59.07 0.74 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.908 0.385 . . . . 0.0 110.034 -179.323 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 11.0 mt-30 -44.3 -26.05 0.29 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.525 -179.629 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 49.5 m -70.39 -46.12 64.65 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.896 179.798 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.76 -32.25 73.85 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.327 179.867 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 57.7 t -70.38 -50.63 44.64 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.273 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.689 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 11.2 t -58.08 -43.27 86.95 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.341 -179.664 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -62.12 -50.87 70.18 Favored 'General case' 0 C--O 1.239 0.501 0 CA-C-O 121.048 0.451 . . . . 0.0 110.79 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 86.6 mt-30 -63.36 -35.42 80.34 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.312 179.72 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 6.7 tp -62.99 -44.67 95.41 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.301 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -61.77 -40.7 96.11 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.796 0.331 . . . . 0.0 110.293 179.878 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 89.3 t -65.73 -54.28 29.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 C-N-CA 120.159 -0.616 . . . . 0.0 110.594 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 91.1 mt -60.9 -39.21 88.44 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.879 0.371 . . . . 0.0 110.059 -179.591 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 77.3 ttt-85 -59.63 -40.91 89.17 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.399 179.744 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 13.4 m120 -56.89 -47.53 80.27 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.338 -179.253 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.519 HD22 ' N ' ' A' ' 73' ' ' LEU . 4.0 mm? -65.89 -41.28 91.74 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.685 179.321 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 110.19 33.54 2.53 Favored Glycine 0 CA--C 1.526 0.749 0 N-CA-C 110.978 -0.849 . . . . 0.0 110.978 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.504 HD22 ' N ' ' A' ' 75' ' ' LEU . 3.8 mm? -91.2 -18.37 24.54 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.781 0.324 . . . . 0.0 110.601 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 31.6 m -136.38 160.13 38.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.159 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 46.5 t -134.54 142.07 41.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.421 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -115.57 140.7 16.42 Favored Glycine 0 CA--C 1.525 0.66 0 N-CA-C 110.496 -1.042 . . . . 0.0 110.496 179.299 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -118.32 105.21 11.5 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 120.837 0.351 . . . . 0.0 110.385 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 59.4 ttt85 -75.54 123.77 26.04 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.356 179.796 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -131.29 144.94 51.65 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.232 179.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -43.91 -35.83 3.49 Favored Glycine 0 CA--C 1.524 0.603 0 N-CA-C 110.778 -0.929 . . . . 0.0 110.778 -179.661 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 61.5 ttm-85 -70.71 -45.47 64.88 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.848 -0.341 . . . . 0.0 110.494 179.729 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 3.5 m 177.81 176.35 0.43 Allowed 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 121.017 0.437 . . . . 0.0 110.03 -179.564 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 2.1 tp -97.63 131.16 45.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.036 -0.529 . . . . 0.0 109.698 178.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 54.5 t -111.73 134.34 54.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.222 179.126 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 65.4 m-85 -110.72 133.22 53.53 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.325 179.787 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 26.0 t -151.14 172.13 16.27 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.143 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 60.3 mt -69.61 147.67 50.38 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.629 -179.728 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 6.9 t80 -54.54 -47.66 72.91 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.36 -179.668 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 45.6 t0 -147.03 165.29 30.34 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.869 0.366 . . . . 0.0 110.601 -179.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . 0.556 ' O ' ' HB3' ' A' ' 95' ' ' ALA . 80.8 p -75.1 -22.32 58.33 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.578 -179.931 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 25.6 m170 -40.22 -66.13 0.34 Allowed 'General case' 0 C--O 1.236 0.368 0 CA-C-O 121.101 0.477 . . . . 0.0 110.637 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 22.7 m -50.48 -35.35 12.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.101 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.556 ' HB3' ' O ' ' A' ' 92' ' ' THR . . . -64.55 -41.06 96.56 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.542 179.607 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 96.5 mm-40 -61.27 -45.79 93.05 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.925 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 15.2 tp -60.09 -43.53 95.45 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.302 -0.559 . . . . 0.0 110.102 -179.632 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 52.3 tp -64.21 -38.06 89.7 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.077 -179.77 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 99.9 m-20 -60.99 -43.5 98.74 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.233 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -67.02 -43.83 81.81 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.352 179.334 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.07 -44.04 91.81 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.183 -0.462 . . . . 0.0 109.78 179.216 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 4.8 mm -63.85 -43.71 97.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 121.213 0.53 . . . . 0.0 110.588 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -60.73 -44.4 96.71 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.082 -179.886 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . 0.623 ' ND1' ' N ' ' A' ' 105' ' ' SER . 0.0 OUTLIER -67.72 -34.65 77.28 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.103 179.523 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.623 ' N ' ' ND1' ' A' ' 104' ' ' HIS . 5.6 t -59.15 -50.59 73.46 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.383 -178.141 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 13.2 tm-20 -75.35 -52.89 9.72 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.93 179.265 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 4.2 m-70 -48.71 -28.58 3.68 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.123 -178.733 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 66.9 mt -111.58 -67.3 1.01 Allowed 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.542 179.286 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . 0.523 ' N ' ' O ' ' A' ' 105' ' ' SER . 49.5 t-80 55.32 70.34 0.64 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.491 -179.801 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 96.1 mt -63.03 -41.62 99.58 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.392 -179.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . 0.441 ' O ' ' O ' ' A' ' 112' ' ' LEU . . . 80.42 -160.7 44.11 Favored Glycine 0 CA--C 1.524 0.621 0 N-CA-C 110.868 -0.893 . . . . 0.0 110.868 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.551 HD12 ' N ' ' A' ' 112' ' ' LEU . 10.3 mp 56.42 157.84 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.998 0.428 . . . . 0.0 110.43 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 26.7 p -78.68 165.83 23.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.302 179.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . 0.501 ' O ' ' N ' ' A' ' 116' ' ' HIS . 43.7 p-10 -133.75 148.73 51.43 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.45 179.815 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.518 ' O ' ' CG ' ' A' ' 116' ' ' HIS . 84.8 mtp180 53.26 -86.35 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.487 -179.706 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . 0.518 ' CG ' ' O ' ' A' ' 115' ' ' ARG . 44.7 p-80 40.43 71.21 1.29 Allowed Pre-proline 0 C--N 1.332 -0.157 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.583 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_exo -58.84 143.17 99.41 Favored 'Trans proline' 0 C--N 1.305 -1.735 0 C-N-CA 122.756 2.304 . . . . 0.0 112.052 -179.627 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 48.0 m -60.96 -43.32 98.93 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.478 179.82 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -67.8 142.89 56.05 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.623 179.844 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.219 -0.814 0 CA-C-O 118.072 -1.404 . . . . 0.0 110.92 -179.888 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.333 0 N-CA-C 109.549 -1.42 . . . . 0.0 109.549 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 75.0 m80 -65.67 -40.79 92.79 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.787 0.327 . . . . 0.0 110.451 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 123' ' ' GLY . . . . . 0.431 ' O ' ' O ' ' B' ' 124' ' ' VAL . . . 74.22 -169.89 53.68 Favored Glycine 0 CA--C 1.524 0.623 0 N-CA-C 111.011 -0.836 . . . . 0.0 111.011 179.897 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 124' ' ' VAL . . . . . 0.431 ' O ' ' O ' ' B' ' 123' ' ' GLY . 7.3 t 56.94 113.58 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.805 0.335 . . . . 0.0 110.475 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 125' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -121.17 125.78 48.02 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.463 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 49.22 82.07 0.04 OUTLIER Glycine 0 CA--C 1.524 0.638 0 N-CA-C 110.834 -0.907 . . . . 0.0 110.834 179.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 127' ' ' ARG . . . . . . . . . . . . . 61.1 ttm-85 -60.81 -43.73 97.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.747 0.308 . . . . 0.0 110.552 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 128' ' ' ASN . . . . . 0.419 ' O ' ' OD1' ' B' ' 128' ' ' ASN . 47.9 p-10 -155.33 128.08 8.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.386 179.956 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 129' ' ' ARG . . . . . 0.49 ' N ' ' CD ' ' B' ' 130' ' ' PRO . 27.4 ttm180 -171.13 51.44 0.16 Allowed Pre-proline 0 C--N 1.328 -0.366 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.475 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 130' ' ' PRO . . . . . 0.49 ' CD ' ' N ' ' B' ' 129' ' ' ARG . 37.5 Cg_endo -65.72 143.34 73.85 Favored 'Trans proline' 0 C--N 1.306 -1.694 0 C-N-CA 122.731 2.287 . . . . 0.0 111.929 179.929 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 131' ' ' SER . . . . . 0.404 ' O ' ' HB2' ' B' ' 132' ' ' ALA . 17.9 p -82.59 139.92 33.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.324 179.53 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 132' ' ' ALA . . . . . 0.404 ' HB2' ' O ' ' B' ' 131' ' ' SER . . . 178.55 150.88 0.44 Allowed Pre-proline 0 N--CA 1.449 -0.49 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.632 179.546 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 133' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -67.85 116.88 4.52 Favored 'Trans proline' 0 N--CA 1.495 1.576 0 C-N-CA 122.678 2.252 . . . . 0.0 111.793 179.344 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . . . . . . . . . 37.7 mt -102.62 121.28 42.08 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.124 179.897 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 91.0 m-20 -95.99 -53.21 3.75 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-O 121.281 0.563 . . . . 0.0 110.979 179.82 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 5.6 t -57.67 -44.65 85.9 Favored 'General case' 0 C--O 1.24 0.555 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.444 -179.326 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 9.5 mm100 -66.44 -42.17 88.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.35 179.797 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 138' ' ' ALA . . . . . 0.546 ' O ' HG23 ' B' ' 142' ' ' VAL . . . -51.7 -47.51 63.9 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.457 -0.572 . . . . 0.0 109.457 -179.049 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -61.53 -53.45 56.17 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 120.329 -0.548 . . . . 0.0 110.196 178.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -52.66 -47.36 67.16 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 120.74 -0.384 . . . . 0.0 111.088 179.767 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 88.6 mm-40 -56.61 -49.46 74.89 Favored 'General case' 0 C--O 1.241 0.608 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.647 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 142' ' ' VAL . . . . . 0.546 HG23 ' O ' ' B' ' 138' ' ' ALA . 80.3 t -60.94 -38.31 79.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.891 179.617 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 143' ' ' ALA . . . . . 0.697 ' HB2' HD12 ' A' ' 36' ' ' LEU . . . -64.36 -42.02 96.43 Favored 'General case' 0 C--O 1.22 -0.481 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.485 178.819 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 75.3 m -56.3 -50.05 72.54 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.914 0.388 . . . . 0.0 110.956 -178.736 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 145' ' ' THR . . . . . 0.42 ' O ' HD13 ' B' ' 149' ' ' LEU . 1.4 t -65.81 -48.96 69.94 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.925 179.82 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 146' ' ' LEU . . . . . 0.438 HD23 ' HA ' ' B' ' 146' ' ' LEU . 68.9 mt -61.44 -26.4 67.85 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.858 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 147' ' ' GLN . . . . . 0.667 ' NE2' ' NE2' ' A' ' 28' ' ' GLN . 31.0 tp60 -73.25 -59.08 2.87 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.341 179.178 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -56.24 -54.0 50.47 Favored 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 120.761 -0.375 . . . . 0.0 110.728 -179.319 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.512 ' O ' ' O ' ' B' ' 150' ' ' ALA . 7.4 mp -46.47 -34.75 5.01 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.266 -179.105 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 150' ' ' ALA . . . . . 0.512 ' O ' ' O ' ' B' ' 149' ' ' LEU . . . -57.6 -130.81 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.548 0 O-C-N 123.641 0.588 . . . . 0.0 109.955 179.381 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 151' ' ' THR . . . . . 0.49 ' O ' ' O ' ' B' ' 150' ' ' ALA . 0.7 OUTLIER 52.85 111.81 0.01 OUTLIER Pre-proline 0 CA--C 1.542 0.66 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.393 179.72 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -49.69 -57.02 2.58 Favored 'Trans proline' 0 N--CA 1.496 1.624 0 C-N-CA 122.149 1.899 . . . . 0.0 113.425 -179.381 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 61.1 p -53.36 -46.34 69.54 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.165 -178.135 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 10.6 mpt_? -61.28 -42.41 98.6 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.51 -179.623 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 155' ' ' LEU . . . . . 0.682 HD12 ' HB2' ' A' ' 24' ' ' ALA . 4.9 mt -61.58 -51.8 67.05 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 120.375 -0.53 . . . . 0.0 110.749 -179.178 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 156' ' ' MET . . . . . . . . . . . . . 11.4 tpt -53.91 -48.83 69.76 Favored 'General case' 0 C--O 1.24 0.6 0 C-N-CA 120.263 -0.575 . . . . 0.0 110.351 -179.664 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 157' ' ' ILE . . . . . 0.419 ' O ' ' HG2' ' B' ' 160' ' ' GLN . 96.6 mt -63.38 -45.41 98.15 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 CA-C-O 121.67 0.748 . . . . 0.0 110.395 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 52.4 mt -62.33 -38.29 88.9 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.574 179.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 11.7 m -59.42 -42.7 92.44 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.977 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 160' ' ' GLN . . . . . 0.853 ' NE2' HD11 ' B' ' 171' ' ' LEU . 0.0 OUTLIER -57.14 -44.33 83.29 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 120.384 -0.526 . . . . 0.0 110.316 179.875 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 161' ' ' LEU . . . . . 0.596 ' N ' ' HG2' ' B' ' 160' ' ' GLN . 13.9 mt -64.55 -37.25 86.89 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.254 -179.335 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 162' ' ' ARG . . . . . . . . . . . . . 73.5 ttp85 -52.19 -38.2 57.11 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.323 -179.363 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 49.8 t-20 -56.32 -40.76 74.9 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.86 0.362 . . . . 0.0 110.212 -179.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . 153.18 178.07 27.37 Favored Glycine 0 CA--C 1.524 0.612 0 N-CA-C 111.17 -0.772 . . . . 0.0 111.17 179.09 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_exo -69.08 143.83 55.52 Favored 'Trans proline' 0 C--N 1.312 -1.382 0 C-N-CA 122.764 2.309 . . . . 0.0 112.103 -179.723 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 166' ' ' LEU . . . . . 0.568 ' O ' HD12 ' B' ' 166' ' ' LEU . 0.3 OUTLIER -165.69 159.48 13.42 Favored Pre-proline 0 C--N 1.326 -0.427 0 C-N-CA 120.336 -0.546 . . . . 0.0 110.714 179.682 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -63.81 142.53 83.04 Favored 'Trans proline' 0 N--CA 1.495 1.598 0 C-N-CA 122.413 2.075 . . . . 0.0 112.367 178.782 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . 48.0 t -62.69 -42.85 97.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.398 179.437 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 169' ' ' THR . . . . . 0.46 HG23 HE22 ' B' ' 179' ' ' GLN . 17.0 m -55.83 -69.18 0.15 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.817 -179.608 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 47.6 t0 -52.39 -40.42 62.05 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-O 121.362 0.601 . . . . 0.0 109.818 -179.18 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 171' ' ' LEU . . . . . 0.853 HD11 ' NE2' ' B' ' 160' ' ' GLN . 2.9 tm? -59.59 -47.95 83.55 Favored 'General case' 0 N--CA 1.439 -0.975 0 C-N-CA 119.707 -0.797 . . . . 0.0 110.413 -179.589 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 172' ' ' ALA . . . . . 0.553 ' O ' ' N ' ' B' ' 177' ' ' MET . . . -56.36 -39.69 73.31 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.345 0.593 . . . . 0.0 110.252 -179.444 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -64.3 -28.45 69.72 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.575 179.312 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 174' ' ' ALA . . . . . 0.419 ' HB3' ' O ' ' B' ' 171' ' ' LEU . . . -63.64 -41.0 98.28 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.093 -179.921 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 6.0 tt -168.72 -33.5 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.895 -179.392 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . -54.78 -63.87 4.85 Favored Glycine 0 CA--C 1.523 0.552 0 C-N-CA 120.812 -0.709 . . . . 0.0 111.472 -178.156 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 177' ' ' MET . . . . . 0.553 ' N ' ' O ' ' B' ' 172' ' ' ALA . 3.4 mmt 56.07 29.22 14.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.716 0.293 . . . . 0.0 110.269 -179.917 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 86.4 mt-10 -155.35 60.87 0.63 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.36 -179.575 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 179' ' ' GLN . . . . . 0.46 HE22 HG23 ' B' ' 169' ' ' THR . 18.0 mt-30 -47.1 -28.19 1.66 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.504 -179.583 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 48.0 m -69.92 -45.4 67.62 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.769 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -65.02 -32.21 73.83 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.437 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 63.5 t -70.22 -50.5 46.44 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.266 0 C-N-CA 120.873 -0.331 . . . . 0.0 110.755 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 13.5 t -58.7 -41.81 87.13 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.217 -179.856 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -62.6 -50.97 69.16 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-O 121.089 0.471 . . . . 0.0 110.779 -179.963 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -64.12 -34.12 77.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.145 179.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 7.2 tp -63.47 -45.15 92.12 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.172 179.906 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -61.81 -41.74 98.14 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.752 0.31 . . . . 0.0 110.262 -179.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 83.9 t -64.07 -54.67 28.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 C-N-CA 120.107 -0.637 . . . . 0.0 110.474 -179.834 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 93.0 mt -61.07 -39.07 88.5 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 -179.445 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 73.0 ttt-85 -58.72 -40.43 83.73 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.482 179.746 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 17.6 m120 -58.17 -46.43 85.74 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.674 -0.41 . . . . 0.0 110.442 -179.468 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 192' ' ' LEU . . . . . 0.519 ' N ' HD22 ' B' ' 192' ' ' LEU . 3.9 mm? -66.49 -41.01 89.59 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.631 179.4 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 108.74 34.57 2.59 Favored Glycine 0 CA--C 1.524 0.608 0 N-CA-C 111.015 -0.834 . . . . 0.0 111.015 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 194' ' ' LEU . . . . . 0.505 HD22 ' N ' ' B' ' 194' ' ' LEU . 3.9 mm? -92.31 -17.6 24.5 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.82 0.343 . . . . 0.0 110.519 179.942 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 27.5 m -137.29 160.49 35.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.232 179.864 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 196' ' ' VAL . . . . . . . . . . . . . 50.4 t -135.49 143.59 36.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.284 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 197' ' ' GLY . . . . . . . . . . . . . . . -117.09 141.15 16.45 Favored Glycine 0 CA--C 1.523 0.575 0 N-CA-C 110.643 -0.983 . . . . 0.0 110.643 179.605 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -118.11 105.49 11.88 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 120.864 0.364 . . . . 0.0 110.466 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 61.2 ttt85 -75.46 123.94 26.29 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.18 179.82 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 200' ' ' ALA . . . . . . . . . . . . . . . -130.94 145.41 52.02 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.396 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 201' ' ' GLY . . . . . . . . . . . . . . . -44.21 -38.23 4.85 Favored Glycine 0 CA--C 1.523 0.54 0 N-CA-C 110.666 -0.974 . . . . 0.0 110.666 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 202' ' ' ARG . . . . . . . . . . . . . 63.1 ttm-85 -68.29 -45.32 73.39 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.763 -0.375 . . . . 0.0 110.57 179.699 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 3.6 m 177.44 176.73 0.37 Allowed 'General case' 0 N--CA 1.454 -0.249 0 CA-C-O 121.097 0.475 . . . . 0.0 109.902 -179.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 2.4 tp -96.98 133.65 37.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.689 178.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 58.5 t -114.75 135.31 55.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.189 179.38 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 -111.85 133.84 53.8 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.429 179.691 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 45.5 t -151.78 172.33 16.31 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.211 179.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . 56.8 mt -69.11 147.72 51.02 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.56 -179.729 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 7.2 t80 -54.56 -46.29 73.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.257 -179.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 210' ' ' ASP . . . . . 0.509 ' OD2' ' CD2' ' B' ' 212' ' ' HIS . 45.2 t0 -147.91 170.58 17.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.557 -179.665 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 211' ' ' THR . . . . . 0.492 ' O ' ' HB3' ' B' ' 214' ' ' ALA . 81.6 p -80.14 -19.36 47.41 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.63 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 212' ' ' HIS . . . . . 0.509 ' CD2' ' OD2' ' B' ' 210' ' ' ASP . 22.3 m170 -43.38 -65.84 0.45 Allowed 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.159 0.504 . . . . 0.0 110.738 -179.851 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 213' ' ' VAL . . . . . 0.427 HG23 ' N ' ' B' ' 214' ' ' ALA . 29.4 m -50.41 -36.8 13.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.214 -179.667 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 214' ' ' ALA . . . . . 0.492 ' HB3' ' O ' ' B' ' 211' ' ' THR . . . -63.16 -40.28 97.1 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.501 179.673 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 97.4 mm-40 -62.36 -45.89 91.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.987 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 216' ' ' LEU . . . . . . . . . . . . . 15.3 tp -59.62 -43.55 93.76 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.227 -0.589 . . . . 0.0 110.02 -179.551 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 56.1 tp -63.89 -39.58 94.5 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.046 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 99.9 m-20 -59.41 -44.04 92.9 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.352 -179.599 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 219' ' ' GLU . . . . . . . . . . . . . 67.7 mm-40 -66.26 -44.02 84.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.457 179.105 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -59.32 -44.17 92.61 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 179.284 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 4.7 mm -63.36 -44.01 98.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 121.158 0.504 . . . . 0.0 110.457 -179.886 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 222' ' ' TYR . . . . . 0.441 ' O ' ' CG ' ' B' ' 226' ' ' HIS . 3.8 m-85 -61.2 -42.83 99.29 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.111 -179.801 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 223' ' ' HIS . . . . . 0.629 ' ND1' ' N ' ' B' ' 224' ' ' SER . 0.0 OUTLIER -68.76 -36.37 78.25 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.061 0.458 . . . . 0.0 110.228 179.431 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 224' ' ' SER . . . . . 0.629 ' N ' ' ND1' ' B' ' 223' ' ' HIS . 41.6 t -58.84 -49.09 79.04 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.122 -178.097 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 9.6 tm-20 -75.58 -54.42 7.02 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.955 179.135 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 226' ' ' HIS . . . . . 0.441 ' CG ' ' O ' ' B' ' 222' ' ' TYR . 4.7 m-70 -48.1 -26.89 2.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.21 -178.695 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 227' ' ' LEU . . . . . 0.433 HD12 ' CD2' ' B' ' 223' ' ' HIS . 57.9 mt -112.84 -68.32 0.94 Allowed 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.48 179.302 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 228' ' ' HIS . . . . . 0.531 ' N ' ' O ' ' B' ' 224' ' ' SER . 52.1 t-80 56.38 69.89 0.7 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.542 179.97 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 229' ' ' LEU . . . . . . . . . . . . . 59.6 mt -63.42 -40.32 96.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.517 179.786 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 230' ' ' GLY . . . . . 0.438 ' O ' ' O ' ' B' ' 231' ' ' LEU . . . 78.88 -159.22 45.52 Favored Glycine 0 CA--C 1.524 0.597 0 N-CA-C 110.803 -0.919 . . . . 0.0 110.803 -179.955 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 231' ' ' LEU . . . . . 0.554 ' N ' HD12 ' B' ' 231' ' ' LEU . 10.3 mp 56.3 156.75 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.06 0.457 . . . . 0.0 110.403 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 232' ' ' SER . . . . . . . . . . . . . 27.1 p -78.66 162.98 25.84 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.405 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 233' ' ' ASP . . . . . 0.46 ' O ' ' N ' ' B' ' 235' ' ' HIS . 44.5 p-10 -130.93 148.4 52.69 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.448 179.907 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 234' ' ' ARG . . . . . 0.524 ' O ' ' CG ' ' B' ' 235' ' ' HIS . 85.0 mtp180 53.88 -87.47 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.551 -179.884 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 235' ' ' HIS . . . . . 0.524 ' CG ' ' O ' ' B' ' 234' ' ' ARG . 46.9 p-80 40.43 71.63 1.2 Allowed Pre-proline 0 N--CA 1.462 0.173 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.566 -179.796 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 236' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -58.31 144.0 96.61 Favored 'Trans proline' 0 C--N 1.305 -1.711 0 C-N-CA 122.757 2.305 . . . . 0.0 112.042 -179.693 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 237' ' ' SER . . . . . . . . . . . . . 68.1 m -60.68 -43.55 97.56 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.52 179.777 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 238' ' ' ALA . . . . . . . . . . . . . . . -69.73 146.19 51.7 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.583 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.725 0 CA-C-O 117.993 -1.448 . . . . 0.0 110.919 -179.985 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.316 0 N-CA-C 109.546 -1.421 . . . . 0.0 109.546 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 94.0 m-70 -61.75 -40.71 96.1 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.832 0.349 . . . . 0.0 110.65 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -64.24 -43.71 96.62 Favored Glycine 0 CA--C 1.523 0.556 0 N-CA-C 111.057 -0.817 . . . . 0.0 111.057 -179.845 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 14.6 p -142.63 142.71 26.48 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.255 0 CA-C-O 120.862 0.363 . . . . 0.0 110.527 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -59.64 142.46 52.86 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.292 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -47.0 159.54 0.37 Allowed Glycine 0 CA--C 1.522 0.469 0 N-CA-C 110.872 -0.891 . . . . 0.0 110.872 -179.864 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 80.1 mtp85 -82.79 128.27 34.24 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.7 0.286 . . . . 0.0 110.302 -179.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -103.73 5.01 35.9 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.656 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.592 ' N ' ' CD ' ' A' ' 11' ' ' PRO . 2.6 ttp85 -74.71 -44.55 5.3 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 116.287 -0.415 . . . . 0.0 109.944 179.792 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.592 ' CD ' ' N ' ' A' ' 10' ' ' ARG . 22.4 Cg_exo -63.16 146.82 94.39 Favored 'Trans proline' 0 C--N 1.308 -1.565 0 C-N-CA 122.816 2.344 . . . . 0.0 111.625 -179.748 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 40.5 m -149.04 152.42 36.2 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.321 179.475 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 64.07 70.92 0.63 Allowed Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.738 -179.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_exo -60.95 143.76 99.42 Favored 'Trans proline' 0 C--N 1.306 -1.669 0 C-N-CA 122.945 2.43 . . . . 0.0 111.802 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.546 ' O ' ' N ' ' A' ' 17' ' ' SER . 31.3 mt -82.73 115.42 21.65 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.972 179.776 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.506 ' O ' ' N ' ' A' ' 19' ' ' ALA . 19.1 t70 -41.02 -18.92 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.82 179.907 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.546 ' N ' ' O ' ' A' ' 15' ' ' LEU . 42.2 t -38.72 -42.33 0.79 Allowed 'General case' 0 C--O 1.241 0.657 0 CA-C-O 121.375 0.607 . . . . 0.0 110.381 -179.961 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 54.6 mt-30 -65.32 -43.3 91.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.164 179.022 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.506 ' N ' ' O ' ' A' ' 16' ' ' ASP . . . -62.61 -31.44 72.28 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.108 179.639 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.88 -53.27 53.21 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 179.683 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.37 -46.14 83.69 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.489 -0.484 . . . . 0.0 110.81 179.365 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 59.3 tt0 -56.1 -51.11 69.07 Favored 'General case' 0 C--O 1.242 0.668 0 CA-C-O 121.544 0.687 . . . . 0.0 110.38 -179.778 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 75.2 t -62.41 -43.31 98.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.753 179.558 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.461 ' HB2' HD12 ' B' ' 155' ' ' LEU . . . -49.39 -50.22 41.22 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.299 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 58.1 m -59.18 -42.34 90.59 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 91.2 m -63.31 -50.92 68.13 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 120.363 -0.535 . . . . 0.0 111.105 179.869 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 96.0 mt -68.35 -22.16 64.69 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.56 -179.739 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.502 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 49.5 tt0 -74.69 -58.0 3.57 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.281 179.559 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.6 -54.14 50.38 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.722 -0.391 . . . . 0.0 110.283 -179.731 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.496 ' O ' ' O ' ' A' ' 31' ' ' ALA . 77.1 mt -44.91 -33.14 1.86 Allowed 'General case' 0 CA--C 1.513 -0.481 0 C-N-CA 121.024 -0.27 . . . . 0.0 110.458 -179.198 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.502 ' HB3' ' O ' ' A' ' 28' ' ' GLN . . . -57.61 -128.27 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.12 179.233 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.47 ' HG1' ' HB3' ' A' ' 35' ' ' ARG . 0.6 OUTLIER 54.26 107.18 0.03 OUTLIER Pre-proline 0 CA--C 1.54 0.579 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.571 -179.959 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -49.27 -58.68 1.6 Allowed 'Trans proline' 0 N--CA 1.496 1.663 0 C-N-CA 122.165 1.91 . . . . 0.0 113.429 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 78.4 p -55.54 -43.33 75.69 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.802 -179.149 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.47 ' HB3' ' HG1' ' A' ' 32' ' ' THR . 44.4 ttm180 -61.06 -44.29 97.61 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 120.817 -0.353 . . . . 0.0 110.663 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.468 HD12 ' HB2' ' B' ' 143' ' ' ALA . 7.1 mt -61.03 -45.74 93.57 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.467 -0.493 . . . . 0.0 110.908 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.614 ' SD ' HD11 ' A' ' 56' ' ' ILE . 0.0 OUTLIER -55.21 -46.79 75.91 Favored 'General case' 0 C--N 1.319 -0.741 0 C-N-CA 120.15 -0.62 . . . . 0.0 110.163 -179.886 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.484 ' CD1' ' OE1' ' A' ' 66' ' ' GLN . 65.0 mt -63.72 -45.34 97.59 Favored 'Isoleucine or valine' 0 C--O 1.239 0.532 0 CA-C-O 121.601 0.715 . . . . 0.0 110.734 -179.824 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -63.28 -40.95 98.83 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.765 179.827 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.437 ' OG1' ' O ' ' A' ' 37' ' ' MET . 15.3 p -61.42 -37.34 83.15 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.944 179.974 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -62.1 -47.46 84.53 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.516 -0.474 . . . . 0.0 109.855 179.335 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 29.3 mt -64.54 -35.39 80.8 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.762 179.525 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 62.5 ttp180 -55.15 -31.94 61.73 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.57 -179.521 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 98.4 m-20 -61.15 -41.03 96.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.507 -179.647 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.42 ' O ' ' CD2' ' A' ' 47' ' ' LEU . . . 155.83 -160.38 29.96 Favored Glycine 0 CA--C 1.528 0.847 0 N-CA-C 110.951 -0.86 . . . . 0.0 110.951 180.0 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_exo -61.67 144.08 97.07 Favored 'Trans proline' 0 C--N 1.309 -1.528 0 C-N-CA 122.96 2.44 . . . . 0.0 111.976 179.499 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.43 HD12 ' O ' ' A' ' 47' ' ' LEU . 0.3 OUTLIER 176.95 94.21 0.12 Allowed Pre-proline 0 CA--C 1.538 0.507 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.353 179.706 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo -48.32 177.88 0.01 OUTLIER 'Trans proline' 0 C--N 1.297 -2.155 0 C-N-CA 122.282 1.988 . . . . 0.0 112.485 -179.737 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.521 HG23 ' N ' ' A' ' 50' ' ' THR . 4.7 m -59.97 -42.39 89.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 121.51 0.671 . . . . 0.0 110.367 -179.759 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.521 ' N ' HG23 ' A' ' 49' ' ' VAL . 11.1 m -59.87 -41.4 91.43 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.007 -0.997 . . . . 0.0 110.537 179.641 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -73.95 -46.58 43.21 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.702 179.57 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.682 HD23 ' O ' ' A' ' 52' ' ' LEU . 5.2 tt -61.42 -45.52 93.97 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.586 -179.281 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.86 -46.33 78.85 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.666 -0.414 . . . . 0.0 111.281 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -55.61 -35.81 66.27 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.138 -179.429 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.484 ' O ' HG23 ' A' ' 56' ' ' ILE . . . -50.96 -59.59 3.98 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.516 -0.473 . . . . 0.0 110.708 -179.291 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.614 HD11 ' SD ' ' A' ' 37' ' ' MET . 2.2 pp -158.84 -18.17 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.605 -179.704 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -58.84 -64.78 3.98 Favored Glycine 0 CA--C 1.523 0.552 0 N-CA-C 111.209 -0.756 . . . . 0.0 111.209 -179.171 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.488 ' O ' ' SD ' ' A' ' 58' ' ' MET . 0.0 OUTLIER 67.73 40.45 2.45 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.713 0.292 . . . . 0.0 110.328 179.996 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.477 ' O ' ' N ' ' A' ' 61' ' ' SER . 72.1 tt0 -169.01 60.86 0.05 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 13.1 mt-30 -41.45 -23.12 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.766 -179.434 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.477 ' N ' ' O ' ' A' ' 59' ' ' GLU . 69.3 m -68.7 -43.34 76.24 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.917 179.923 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.461 ' H ' ' HG2' ' A' ' 59' ' ' GLU . . . -68.12 -30.5 69.66 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.628 -179.888 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 59.4 t -72.18 -51.59 29.27 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.294 0 C-N-CA 120.882 -0.327 . . . . 0.0 110.845 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 40.8 t -59.8 -42.28 93.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.33 -179.738 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -62.82 -51.21 67.92 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-O 120.986 0.422 . . . . 0.0 110.995 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.484 ' OE1' ' CD1' ' A' ' 38' ' ' ILE . 73.5 mt-30 -63.66 -36.87 85.27 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.055 0.455 . . . . 0.0 110.471 179.968 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 5.9 tt -62.1 -43.75 98.15 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.479 -179.76 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -62.97 -41.79 99.64 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.862 0.363 . . . . 0.0 110.434 179.459 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 75.5 t -61.52 -54.18 38.42 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.206 0 C-N-CA 119.88 -0.728 . . . . 0.0 110.134 -179.726 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 94.9 mt -62.31 -37.31 85.09 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.175 0.512 . . . . 0.0 109.851 -179.561 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 7.4 tmm_? -57.34 -38.82 74.71 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.454 -179.842 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 99.0 m-20 -62.07 -41.09 97.81 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.421 -179.823 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.447 HD23 ' N ' ' A' ' 73' ' ' LEU . 7.2 mt -66.02 -39.11 89.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.242 -179.488 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 102.79 31.72 5.03 Favored Glycine 0 CA--C 1.525 0.678 0 N-CA-C 111.011 -0.836 . . . . 0.0 111.011 -179.839 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 83.9 mt -95.04 -15.7 23.26 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 120.751 0.31 . . . . 0.0 110.701 179.774 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 33.4 m -136.88 160.7 36.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.088 179.855 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 40.3 t -137.71 150.42 25.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.345 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -124.74 145.89 15.94 Favored Glycine 0 CA--C 1.52 0.397 0 N-CA-C 110.237 -1.145 . . . . 0.0 110.237 179.437 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -120.48 104.64 10.15 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 120.827 0.346 . . . . 0.0 110.469 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 60.1 ttp180 -77.44 125.91 30.07 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.984 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -138.15 148.27 44.74 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.267 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -43.84 -35.36 3.23 Favored Glycine 0 CA--C 1.521 0.417 0 N-CA-C 110.538 -1.025 . . . . 0.0 110.538 -179.707 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 8.5 tpm_? -70.99 -46.72 61.8 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.687 -0.405 . . . . 0.0 110.688 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 3.2 m 176.24 176.8 0.26 Allowed 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 121.193 0.521 . . . . 0.0 109.709 -179.548 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 1.1 tp -102.72 122.6 55.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.567 178.745 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 78.8 t -101.95 129.79 52.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.173 179.055 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 -104.86 129.94 53.09 Favored 'General case' 0 CA--C 1.52 -0.181 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 50.7 m -149.24 171.38 16.58 Favored 'General case' 0 N--CA 1.462 0.151 0 N-CA-C 110.049 -0.352 . . . . 0.0 110.049 -179.685 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 17.7 mt -67.98 148.96 50.33 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.428 -179.304 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -52.01 -44.92 64.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.2 -179.582 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.532 ' OD2' ' CD2' ' A' ' 93' ' ' HIS . 13.2 t70 -147.44 -177.55 5.76 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.327 -179.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . 0.451 ' H ' ' CG ' ' A' ' 91' ' ' ASP . 6.6 p -90.86 -13.46 33.65 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.576 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . 0.532 ' CD2' ' OD2' ' A' ' 91' ' ' ASP . 91.2 m-70 -48.74 -65.08 0.63 Allowed 'General case' 0 C--O 1.235 0.323 0 CA-C-O 120.809 0.337 . . . . 0.0 110.712 179.879 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.46 HG23 ' N ' ' A' ' 95' ' ' ALA . 27.2 m -50.74 -38.79 17.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.062 -179.684 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.46 ' N ' HG23 ' A' ' 94' ' ' VAL . . . -61.66 -41.07 97.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.338 179.778 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 64.6 tp60 -61.92 -45.72 92.46 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.866 -179.615 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 13.0 tp -59.4 -42.32 91.47 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.584 -0.446 . . . . 0.0 110.133 -179.257 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 92.7 mt -63.33 -40.23 96.73 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.149 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . 0.435 ' OD1' ' CE1' ' A' ' 103' ' ' TYR . 65.7 t0 -60.22 -42.58 95.49 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.201 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -67.09 -50.22 62.33 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.491 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -56.19 -43.28 78.3 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 179.621 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 4.6 mm -62.48 -43.69 98.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 C-N-CA 120.384 -0.526 . . . . 0.0 110.439 -179.735 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' TYR . . . . . 0.435 ' CE1' ' OD1' ' A' ' 99' ' ' ASP . 3.3 m-85 -58.87 -41.31 86.77 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.868 -179.942 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 68.7 t60 -65.8 -38.78 89.89 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.619 179.501 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 43.2 t -58.96 -46.32 88.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.24 -179.638 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -75.01 -58.05 3.52 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.008 0.432 . . . . 0.0 110.954 179.228 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 84.7 t60 -50.75 -34.46 27.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.725 -0.671 . . . . 0.0 109.735 -179.341 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 7.0 tp -152.64 104.24 2.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.484 179.432 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . 0.574 ' ND1' ' N ' ' A' ' 109' ' ' HIS . 0.0 OUTLIER -97.07 -74.58 0.57 Allowed 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.237 179.881 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.5 ' N ' HD22 ' A' ' 110' ' ' LEU . 4.3 mm? 49.0 11.63 0.04 OUTLIER 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.304 -179.714 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . 0.494 ' H ' ' C ' ' A' ' 109' ' ' HIS . . . -86.12 -3.31 85.18 Favored Glycine 0 CA--C 1.525 0.7 0 N-CA-C 110.914 -0.875 . . . . 0.0 110.914 179.86 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 81.6 mt -69.38 -17.08 63.64 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.993 0.425 . . . . 0.0 110.414 -179.508 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.492 ' OG ' ' N ' ' A' ' 114' ' ' ASP . 78.7 p -62.81 -69.35 0.27 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.552 -179.859 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . 0.492 ' N ' ' OG ' ' A' ' 113' ' ' SER . 62.6 t0 40.73 66.4 0.64 Allowed 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.779 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 20.6 mmm180 -62.83 -42.4 99.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.491 -179.558 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER 40.14 77.57 0.41 Allowed Pre-proline 0 C--N 1.331 -0.236 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.62 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_exo -56.15 141.12 87.9 Favored 'Trans proline' 0 C--N 1.307 -1.615 0 C-N-CA 122.647 2.231 . . . . 0.0 112.116 -179.628 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 39.5 t -62.48 -44.22 96.93 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.552 179.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . 46.58 -171.75 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.615 -179.843 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.774 0 CA-C-O 117.997 -1.446 . . . . 0.0 110.937 -179.865 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.393 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 94.8 m-70 -65.85 -39.79 91.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.76 0.314 . . . . 0.0 110.511 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 123' ' ' GLY . . . . . . . . . . . . . . . -64.17 -43.03 97.72 Favored Glycine 0 CA--C 1.524 0.638 0 N-CA-C 111.046 -0.821 . . . . 0.0 111.046 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 14.8 p -144.22 142.55 24.0 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.188 0 CA-C-O 120.829 0.347 . . . . 0.0 110.617 179.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 125' ' ' GLU . . . . . . . . . . . . . 73.9 mm-40 -58.56 146.91 34.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.51 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -50.39 160.89 1.24 Allowed Glycine 0 CA--C 1.524 0.604 0 N-CA-C 110.774 -0.931 . . . . 0.0 110.774 -179.808 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 127' ' ' ARG . . . . . . . . . . . . . 80.7 mtp85 -86.82 126.39 34.6 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.905 0.383 . . . . 0.0 110.487 -179.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 128' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -103.12 2.74 35.03 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.637 179.8 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 129' ' ' ARG . . . . . 0.565 ' N ' ' CD ' ' B' ' 130' ' ' PRO . 1.8 ttp85 -68.76 -45.81 33.26 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.609 179.373 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 130' ' ' PRO . . . . . 0.565 ' CD ' ' N ' ' B' ' 129' ' ' ARG . 60.9 Cg_endo -79.24 143.85 17.9 Favored 'Trans proline' 0 C--N 1.31 -1.485 0 C-N-CA 122.531 2.154 . . . . 0.0 111.916 -178.651 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 66.6 m -142.83 162.43 35.48 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.477 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 132' ' ' ALA . . . . . . . . . . . . . . . 62.22 72.01 0.67 Allowed Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.577 -179.77 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 133' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -69.25 147.15 65.5 Favored 'Trans proline' 0 N--CA 1.492 1.418 0 C-N-CA 122.715 2.277 . . . . 0.0 111.846 -179.544 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . 0.54 ' O ' ' N ' ' B' ' 136' ' ' SER . 24.2 mt -80.47 119.7 23.5 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.232 -179.811 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 135' ' ' ASP . . . . . 0.498 ' O ' ' N ' ' B' ' 138' ' ' ALA . 20.3 t70 -41.94 -17.84 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.758 179.681 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . 0.54 ' N ' ' O ' ' B' ' 134' ' ' LEU . 25.8 t -38.47 -42.05 0.71 Allowed 'General case' 0 C--O 1.242 0.659 0 CA-C-O 121.218 0.533 . . . . 0.0 110.484 -179.722 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 74.9 mt-30 -65.45 -43.59 89.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.041 179.146 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 138' ' ' ALA . . . . . 0.498 ' N ' ' O ' ' B' ' 135' ' ' ASP . . . -62.97 -31.34 72.43 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.211 179.729 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -64.12 -53.11 54.75 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 120.957 0.408 . . . . 0.0 109.901 179.677 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -57.63 -46.78 83.7 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.737 179.424 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -55.9 -50.02 71.83 Favored 'General case' 0 C--O 1.242 0.67 0 CA-C-O 121.563 0.697 . . . . 0.0 110.171 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 142' ' ' VAL . . . . . 0.407 HG23 ' O ' ' B' ' 138' ' ' ALA . 77.7 t -62.61 -43.56 98.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.688 179.611 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 143' ' ' ALA . . . . . 0.468 ' HB2' HD12 ' A' ' 36' ' ' LEU . . . -49.63 -49.27 47.73 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.418 179.888 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 55.2 m -59.17 -43.0 92.12 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.33 -0.395 . . . . 0.0 109.977 179.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 89.0 m -63.27 -50.39 70.33 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 120.386 -0.526 . . . . 0.0 110.995 179.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 96.0 mt -68.82 -22.78 64.22 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.799 -179.785 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 147' ' ' GLN . . . . . 0.485 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 49.9 tt0 -74.62 -57.63 3.8 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.402 179.483 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -58.63 -54.13 50.52 Favored 'General case' 0 CA--C 1.519 -0.227 0 C-N-CA 120.57 -0.452 . . . . 0.0 110.388 -179.579 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.501 ' O ' ' O ' ' B' ' 150' ' ' ALA . 77.5 mt -45.26 -33.53 2.42 Favored 'General case' 0 CA--C 1.513 -0.465 0 C-N-CA 121.021 -0.272 . . . . 0.0 110.441 -178.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 150' ' ' ALA . . . . . 0.501 ' O ' ' O ' ' B' ' 149' ' ' LEU . . . -57.1 -128.35 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.238 0.542 . . . . 0.0 110.309 179.363 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 151' ' ' THR . . . . . 0.495 ' HG1' ' C ' ' B' ' 150' ' ' ALA . 0.6 OUTLIER 54.3 108.61 0.02 OUTLIER Pre-proline 0 CA--C 1.541 0.623 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.558 -179.722 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -49.73 -59.18 1.32 Allowed 'Trans proline' 0 N--CA 1.494 1.555 0 C-N-CA 122.197 1.931 . . . . 0.0 113.317 179.73 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 84.3 p -54.92 -43.96 73.78 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.812 -179.101 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 44.2 ttm180 -60.79 -44.43 96.84 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.574 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 155' ' ' LEU . . . . . 0.461 HD12 ' HB2' ' A' ' 24' ' ' ALA . 7.2 mt -60.92 -46.16 91.78 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.365 -0.534 . . . . 0.0 110.694 -179.926 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 156' ' ' MET . . . . . 0.634 ' SD ' HD11 ' B' ' 175' ' ' ILE . 0.0 OUTLIER -54.58 -47.22 73.56 Favored 'General case' 0 C--N 1.318 -0.764 0 C-N-CA 120.116 -0.634 . . . . 0.0 110.131 -179.91 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 157' ' ' ILE . . . . . 0.452 ' CD1' ' OE1' ' B' ' 185' ' ' GLN . 67.4 mt -63.61 -45.78 96.64 Favored 'Isoleucine or valine' 0 C--O 1.239 0.544 0 CA-C-O 121.483 0.658 . . . . 0.0 110.808 -179.757 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -63.01 -40.45 97.81 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.866 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 159' ' ' THR . . . . . 0.443 HG23 ' O ' ' B' ' 155' ' ' LEU . 18.1 p -61.22 -38.17 85.66 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 116.088 -0.505 . . . . 0.0 109.938 -180.0 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 14.4 mm100 -61.52 -47.29 86.27 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.549 -0.46 . . . . 0.0 109.923 179.395 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 161' ' ' LEU . . . . . . . . . . . . . 29.4 mt -64.71 -34.79 79.15 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.837 179.622 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 162' ' ' ARG . . . . . . . . . . . . . 62.6 ttp180 -56.3 -30.79 62.97 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.674 -179.46 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 98.1 m-20 -61.74 -41.1 97.21 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.462 -179.631 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 164' ' ' GLY . . . . . 0.427 ' O ' ' CD2' ' B' ' 166' ' ' LEU . . . 156.49 -160.44 30.22 Favored Glycine 0 CA--C 1.526 0.755 0 N-CA-C 110.887 -0.885 . . . . 0.0 110.887 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_exo -62.13 143.25 94.37 Favored 'Trans proline' 0 C--N 1.308 -1.556 0 C-N-CA 123.016 2.477 . . . . 0.0 112.024 179.434 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 166' ' ' LEU . . . . . 0.427 ' CD2' ' O ' ' B' ' 164' ' ' GLY . 0.3 OUTLIER 177.96 95.13 0.14 Allowed Pre-proline 0 CA--C 1.538 0.499 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.408 179.682 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_exo -48.51 177.94 0.02 OUTLIER 'Trans proline' 0 C--N 1.299 -2.075 0 C-N-CA 122.353 2.035 . . . . 0.0 112.377 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 168' ' ' VAL . . . . . 0.514 HG23 ' N ' ' B' ' 169' ' ' THR . 4.2 m -59.87 -42.36 88.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 121.589 0.709 . . . . 0.0 110.388 -179.728 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 169' ' ' THR . . . . . 0.514 ' N ' HG23 ' B' ' 168' ' ' VAL . 9.8 m -59.48 -40.84 88.29 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.454 179.902 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -74.11 -46.33 43.41 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.759 179.517 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 171' ' ' LEU . . . . . 0.681 HD23 ' O ' ' B' ' 171' ' ' LEU . 4.8 tt -61.64 -44.2 97.43 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.348 -178.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 172' ' ' ALA . . . . . . . . . . . . . . . -67.35 -46.94 71.91 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.131 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 82.3 tt0 -54.93 -36.38 65.2 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.219 -179.479 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 174' ' ' ALA . . . . . 0.506 ' O ' HG23 ' B' ' 175' ' ' ILE . . . -51.15 -59.6 4.01 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.463 -0.495 . . . . 0.0 110.821 -179.19 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 175' ' ' ILE . . . . . 0.634 HD11 ' SD ' ' B' ' 156' ' ' MET . 2.2 pp -159.08 -17.4 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.567 -179.493 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . -60.12 -64.17 4.4 Favored Glycine 0 CA--C 1.524 0.595 0 N-CA-C 111.112 -0.795 . . . . 0.0 111.112 -179.347 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 177' ' ' MET . . . . . 0.495 ' O ' ' SD ' ' B' ' 177' ' ' MET . 0.0 OUTLIER 66.71 40.78 3.16 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.707 0.289 . . . . 0.0 110.268 179.927 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 178' ' ' GLU . . . . . 0.49 ' O ' ' N ' ' B' ' 180' ' ' SER . 71.9 tt0 -168.33 60.41 0.06 Allowed 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 179.919 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 13.2 mt-30 -41.27 -22.82 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.766 -179.378 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 180' ' ' SER . . . . . 0.49 ' N ' ' O ' ' B' ' 178' ' ' GLU . 49.1 m -68.84 -43.85 74.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.99 179.831 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 181' ' ' ALA . . . . . 0.485 ' H ' ' HG2' ' B' ' 178' ' ' GLU . . . -68.02 -30.16 69.34 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.591 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 57.9 t -72.03 -51.66 29.49 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 C-N-CA 120.811 -0.356 . . . . 0.0 110.893 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 6.5 t -59.54 -42.61 92.73 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.255 -179.763 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -62.85 -50.69 69.95 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 120.931 0.396 . . . . 0.0 110.979 -179.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 185' ' ' GLN . . . . . 0.452 ' OE1' ' CD1' ' B' ' 157' ' ' ILE . 74.2 mt-30 -63.62 -36.72 84.75 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.533 179.915 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 5.8 tt -62.79 -44.07 97.14 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.662 -179.818 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -62.51 -41.78 99.06 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.413 179.607 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 76.8 t -61.66 -54.26 37.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 C-N-CA 119.881 -0.728 . . . . 0.0 110.174 -179.765 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 86.6 mt -62.26 -37.49 85.65 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.233 0.54 . . . . 0.0 109.954 -179.517 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 7.3 tmm_? -56.93 -40.07 75.67 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.454 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -61.33 -41.28 96.77 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.881 0.372 . . . . 0.0 110.325 -179.512 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 192' ' ' LEU . . . . . 0.463 ' N ' HD23 ' B' ' 192' ' ' LEU . 7.3 mt -65.53 -38.89 90.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.398 -179.508 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 102.46 30.26 5.67 Favored Glycine 0 CA--C 1.524 0.633 0 N-CA-C 110.857 -0.897 . . . . 0.0 110.857 -179.844 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 94.6 mt -93.66 -16.37 24.37 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.85 0.357 . . . . 0.0 110.689 179.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 35.7 m -136.53 160.47 37.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.323 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 196' ' ' VAL . . . . . . . . . . . . . 42.8 t -138.42 152.38 25.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.159 179.783 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 197' ' ' GLY . . . . . . . . . . . . . . . -127.44 147.64 17.15 Favored Glycine 0 CA--C 1.523 0.565 0 N-CA-C 110.448 -1.061 . . . . 0.0 110.448 179.685 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -119.97 106.63 12.21 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 120.897 0.38 . . . . 0.0 110.524 179.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 59.7 ttp180 -79.88 123.43 27.75 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.191 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 200' ' ' ALA . . . . . . . . . . . . . . . -135.99 146.76 47.55 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.283 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 201' ' ' GLY . . . . . . . . . . . . . . . -42.43 -35.36 1.9 Allowed Glycine 0 CA--C 1.521 0.436 0 N-CA-C 110.671 -0.971 . . . . 0.0 110.671 -179.702 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 202' ' ' ARG . . . . . . . . . . . . . 8.1 tpm_? -70.38 -47.74 59.5 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.694 -0.402 . . . . 0.0 110.72 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 3.4 m 177.52 175.91 0.42 Allowed 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 121.092 0.472 . . . . 0.0 109.739 -179.576 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 1.2 tp -102.61 121.92 54.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.531 179.023 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 70.8 t -101.2 129.87 51.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 N-CA-C 109.959 -0.385 . . . . 0.0 109.959 179.046 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 -104.71 129.45 52.91 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 45.3 m -148.82 171.01 16.96 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 110.019 -0.363 . . . . 0.0 110.019 -179.627 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . 18.6 mt -68.41 149.78 48.93 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.454 -179.356 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 9.2 t80 -52.25 -46.44 65.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.316 -179.457 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 210' ' ' ASP . . . . . 0.523 ' OD2' ' CD2' ' B' ' 212' ' ' HIS . 19.0 t70 -146.17 -178.71 6.28 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.791 0.329 . . . . 0.0 110.295 -179.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 211' ' ' THR . . . . . 0.51 ' H ' ' CG ' ' B' ' 210' ' ' ASP . 30.7 p -88.5 -16.47 32.6 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.535 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 212' ' ' HIS . . . . . 0.523 ' CD2' ' OD2' ' B' ' 210' ' ' ASP . 84.2 m-70 -46.47 -65.44 0.55 Allowed 'General case' 0 C--O 1.235 0.312 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.868 -179.834 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 213' ' ' VAL . . . . . 0.446 HG23 ' N ' ' B' ' 214' ' ' ALA . 20.3 m -50.38 -38.42 15.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 121.016 0.436 . . . . 0.0 110.139 -179.561 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 214' ' ' ALA . . . . . 0.446 ' N ' HG23 ' B' ' 213' ' ' VAL . . . -62.21 -40.93 97.74 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.215 179.754 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 68.0 tp60 -62.19 -46.05 90.66 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.871 -179.541 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 216' ' ' LEU . . . . . . . . . . . . . 14.5 tp -59.0 -42.97 91.37 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.003 -179.138 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 88.5 mt -62.8 -40.59 97.83 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.206 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 67.1 t0 -59.37 -43.79 92.83 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.333 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 219' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -66.43 -49.8 65.54 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.438 -0.347 . . . . 0.0 110.547 179.541 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 220' ' ' ALA . . . . . . . . . . . . . . . -56.3 -43.02 78.5 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.855 -0.424 . . . . 0.0 109.855 179.496 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 4.2 mm -62.68 -43.55 98.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 C-N-CA 120.39 -0.524 . . . . 0.0 110.463 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -59.09 -41.3 87.72 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.797 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 223' ' ' HIS . . . . . . . . . . . . . 58.8 t60 -65.84 -37.93 87.53 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.471 179.504 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 6.7 t -58.92 -46.99 86.62 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.389 -179.747 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -75.39 -56.69 4.46 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 121.005 0.431 . . . . 0.0 110.898 179.309 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -50.97 -34.7 30.04 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.864 -179.441 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 227' ' ' LEU . . . . . . . . . . . . . 7.1 tp -152.78 100.94 2.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.641 179.544 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 228' ' ' HIS . . . . . 0.577 ' ND1' ' N ' ' B' ' 228' ' ' HIS . 0.0 OUTLIER -93.15 -75.77 0.49 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.062 179.677 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 229' ' ' LEU . . . . . 0.521 ' H ' ' CG ' ' B' ' 228' ' ' HIS . 4.4 mm? 49.96 9.46 0.04 OUTLIER 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.409 -179.857 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 230' ' ' GLY . . . . . 0.514 ' H ' ' C ' ' B' ' 228' ' ' HIS . . . -84.0 -3.02 89.39 Favored Glycine 0 CA--C 1.524 0.603 0 N-CA-C 110.808 -0.917 . . . . 0.0 110.808 179.883 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 231' ' ' LEU . . . . . . . . . . . . . 83.9 mt -69.13 -18.11 63.92 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.842 0.353 . . . . 0.0 110.492 -179.607 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 232' ' ' SER . . . . . 0.531 ' OG ' ' N ' ' B' ' 233' ' ' ASP . 54.8 p -60.7 -69.53 0.22 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.568 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 233' ' ' ASP . . . . . 0.531 ' N ' ' OG ' ' B' ' 232' ' ' SER . 57.1 t0 40.55 64.86 0.86 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.8 179.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 234' ' ' ARG . . . . . . . . . . . . . 20.9 mmm180 -62.61 -42.43 99.57 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.391 -179.434 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 235' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER 39.99 77.86 0.4 Allowed Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.668 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 236' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -56.63 141.83 91.08 Favored 'Trans proline' 0 C--N 1.307 -1.645 0 C-N-CA 122.691 2.26 . . . . 0.0 112.021 -179.671 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 237' ' ' SER . . . . . . . . . . . . . 37.0 t -63.17 -43.58 97.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.644 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 238' ' ' ALA . . . . . . . . . . . . . . . 45.78 -169.2 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.523 -179.84 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.745 0 CA-C-O 118.061 -1.411 . . . . 0.0 110.9 -179.98 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.248 0 N-CA-C 109.605 -1.398 . . . . 0.0 109.605 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 80.7 m80 -93.67 122.49 36.18 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 120.886 0.374 . . . . 0.0 110.506 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -168.05 158.74 31.68 Favored Glycine 0 CA--C 1.526 0.725 0 N-CA-C 110.936 -0.866 . . . . 0.0 110.936 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 27.5 m -71.9 -22.17 21.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 121.052 0.453 . . . . 0.0 110.682 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.417 ' CD ' ' N ' ' A' ' 7' ' ' GLY . 10.1 tm-20 62.69 137.26 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.379 -179.813 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . 0.417 ' N ' ' CD ' ' A' ' 6' ' ' GLU . . . 78.39 18.76 75.44 Favored Glycine 0 CA--C 1.524 0.614 0 N-CA-C 110.918 -0.873 . . . . 0.0 110.918 179.933 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 52.5 ptt85 -75.52 144.5 41.94 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.808 0.337 . . . . 0.0 110.306 179.863 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -131.47 125.05 31.5 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.303 179.836 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 56.3 mtp180 -85.82 149.14 50.21 Favored Pre-proline 0 CA--C 1.533 0.318 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.628 -179.777 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -69.94 65.31 1.9 Allowed 'Trans proline' 0 N--CA 1.495 1.587 0 C-N-CA 122.591 2.194 . . . . 0.0 111.944 179.357 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 21.1 m -71.24 145.68 49.47 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.999 0.428 . . . . 0.0 110.292 179.88 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.679 ' HB1' ' CD ' ' A' ' 14' ' ' PRO . . . 55.4 179.99 0.03 OUTLIER Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.702 179.748 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.679 ' CD ' ' HB1' ' A' ' 13' ' ' ALA . 24.7 Cg_exo -62.28 163.58 19.92 Favored 'Trans proline' 0 N--CA 1.494 1.527 0 C-N-CA 122.902 2.402 . . . . 0.0 111.804 179.016 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 1.021 ' H ' HD22 ' A' ' 15' ' ' LEU . 0.4 OUTLIER -72.2 55.84 0.33 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.678 -179.876 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -96.07 -60.08 1.71 Allowed 'General case' 0 C--O 1.235 0.332 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.555 179.431 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 98.5 p -58.25 -33.48 69.41 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.459 -179.713 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -67.19 -49.41 64.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.501 179.428 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.486 ' O ' HG23 ' A' ' 23' ' ' VAL . . . -56.81 -36.79 70.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.165 -179.78 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.426 ' HB1' ' HB3' ' B' ' 155' ' ' LEU . . . -66.31 -53.31 37.96 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 120.641 -0.424 . . . . 0.0 110.407 179.565 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.06 -44.95 94.35 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.952 -179.716 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.422 HE22 HD23 ' B' ' 227' ' ' LEU . 64.6 tt0 -58.9 -50.65 73.24 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.255 0.55 . . . . 0.0 110.339 -179.806 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.486 HG23 ' O ' ' A' ' 19' ' ' ALA . 70.9 t -62.1 -44.4 98.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.94 179.562 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.27 -43.13 82.8 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.137 179.836 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 66.2 m -57.56 -43.51 84.56 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 179.793 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 21.4 m -64.22 -49.06 73.46 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.631 -0.428 . . . . 0.0 110.685 179.207 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 85.9 mt -63.42 -22.53 66.94 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.442 -179.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.526 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 57.6 tt0 -75.33 -57.98 3.56 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.654 179.42 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.21 -54.54 44.55 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.932 -179.391 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.549 ' O ' ' O ' ' A' ' 31' ' ' ALA . 3.9 mm? -48.74 -30.4 5.56 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 -178.962 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.549 ' O ' ' O ' ' A' ' 30' ' ' LEU . . . -56.54 -133.95 0.0 OUTLIER 'General case' 0 C--O 1.22 -0.498 0 C-N-CA 120.366 -0.534 . . . . 0.0 110.362 179.102 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.486 ' O ' ' O ' ' A' ' 31' ' ' ALA . 17.7 p 53.85 114.76 0.01 OUTLIER Pre-proline 0 CA--C 1.543 0.679 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.867 -179.807 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_exo -48.76 -44.54 31.1 Favored 'Trans proline' 0 N--CA 1.498 1.754 0 C-N-CA 122.229 1.953 . . . . 0.0 113.026 -179.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 39.5 t -59.92 -45.46 92.49 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.959 -178.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.406 ' HB3' ' HG1' ' A' ' 32' ' ' THR . 15.7 tpp180 -63.4 -36.47 83.82 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.388 -179.954 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.451 ' CD2' ' O ' ' A' ' 30' ' ' LEU . 1.6 mm? -63.15 -54.38 38.66 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.414 -0.514 . . . . 0.0 110.763 -179.181 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.413 ' O ' ' SD ' ' A' ' 37' ' ' MET . 0.0 OUTLIER -57.18 -49.23 76.61 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.008 -0.677 . . . . 0.0 110.639 -179.396 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 36.6 mm -62.62 -42.75 97.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-O 121.193 0.521 . . . . 0.0 110.383 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 42.6 tp -62.38 -43.03 99.77 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.785 -179.911 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.405 ' OG1' ' O ' ' A' ' 37' ' ' MET . 19.7 p -60.71 -35.88 77.43 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.305 -0.407 . . . . 0.0 109.997 -179.446 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -63.46 -45.85 88.91 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.274 -0.571 . . . . 0.0 110.108 178.932 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 98.1 mt -64.94 -42.54 94.55 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.951 179.701 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.532 ' NH1' ' OD1' ' A' ' 99' ' ' ASP . 68.7 ttp85 -52.04 -17.76 1.16 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.428 -179.9 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -75.91 -76.91 0.14 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.908 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -174.45 -143.67 4.51 Favored Glycine 0 CA--C 1.532 1.131 0 C-N-CA 120.539 -0.839 . . . . 0.0 111.217 -179.509 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -50.16 133.08 34.99 Favored 'Trans proline' 0 N--CA 1.493 1.464 0 C-N-CA 122.328 2.019 . . . . 0.0 112.184 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -136.68 66.79 57.53 Favored Pre-proline 0 CA--C 1.536 0.43 0 CA-C-O 121.547 0.689 . . . . 0.0 111.207 -179.941 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -51.61 148.51 20.85 Favored 'Trans proline' 0 C--N 1.299 -2.028 0 C-N-CA 121.852 1.701 . . . . 0.0 111.343 178.185 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 44.4 t -53.32 -51.4 41.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 121.253 0.549 . . . . 0.0 110.574 -178.377 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 48.4 p -62.92 -38.53 91.33 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.529 179.336 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -63.71 -41.39 98.11 Favored 'General case' 0 CA--C 1.514 -0.404 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.933 179.287 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.703 HD13 ' C ' ' A' ' 52' ' ' LEU . 2.8 tm? -61.58 -47.69 84.33 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 119.675 -0.81 . . . . 0.0 110.11 -179.492 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.515 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -52.69 -47.23 67.38 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.006 179.632 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 45.1 tp10 -54.85 -48.09 73.33 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.516 -0.474 . . . . 0.0 110.35 179.751 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -57.31 -54.0 51.71 Favored 'General case' 0 C--O 1.232 0.138 0 C-N-CA 120.493 -0.483 . . . . 0.0 111.012 -179.589 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.413 HD12 HD11 ' A' ' 52' ' ' LEU . 96.6 mt -89.08 -75.02 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.241 179.71 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . 0.515 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 133.02 96.97 0.63 Allowed Glycine 0 CA--C 1.522 0.513 0 N-CA-C 111.391 -0.684 . . . . 0.0 111.391 179.858 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.404 ' HA ' HE21 ' A' ' 60' ' ' GLN . 78.3 mtm 58.32 77.58 0.29 Allowed 'General case' 0 C--O 1.232 0.155 0 C-N-CA 120.974 -0.29 . . . . 0.0 110.878 179.117 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -173.33 32.63 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.25 0.548 . . . . 0.0 110.083 179.733 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.666 ' H ' ' CD ' ' A' ' 60' ' ' GLN . 0.0 OUTLIER -82.72 -25.06 33.27 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.612 -179.162 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.512 ' O ' ' ND1' ' A' ' 65' ' ' HIS . 73.1 m -65.82 -42.94 90.0 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.395 -179.917 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.56 -36.8 76.67 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.506 179.754 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.41 ' O ' HD23 ' A' ' 67' ' ' LEU . 55.1 t -69.78 -52.24 33.39 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.3 0 C-N-CA 120.495 -0.482 . . . . 0.0 110.802 179.759 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 11.7 t -60.44 -44.58 95.67 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.234 -0.587 . . . . 0.0 110.51 179.691 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . 0.579 ' CG ' HH21 ' A' ' 68' ' ' ARG . 0.9 OUTLIER -57.03 -47.54 80.67 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.41 -179.844 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 81.6 mt-30 -59.51 -41.53 90.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.86 0.362 . . . . 0.0 110.836 179.723 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.529 HD13 HG21 ' A' ' 76' ' ' VAL . 3.3 mm? -61.31 -44.14 97.71 Favored 'General case' 0 CA--C 1.513 -0.457 0 C-N-CA 120.616 -0.434 . . . . 0.0 110.56 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.579 HH21 ' CG ' ' A' ' 65' ' ' HIS . 88.2 mtm180 -61.61 -40.82 96.2 Favored 'General case' 0 C--N 1.312 -1.035 0 C-N-CA 120.402 -0.519 . . . . 0.0 110.62 179.777 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.529 HG23 ' O ' ' A' ' 65' ' ' HIS . 94.8 t -58.83 -52.31 61.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 -179.463 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 9.9 mp -67.06 -31.46 71.99 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.854 0.359 . . . . 0.0 110.282 179.042 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.669 HH12 ' N ' ' A' ' 78' ' ' GLY . 9.2 tpt180 -54.65 -43.83 72.69 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.881 -179.169 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -60.8 -43.59 97.96 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.329 -0.548 . . . . 0.0 110.38 179.87 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 10.0 mt -64.91 -38.92 92.59 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.024 0.44 . . . . 0.0 110.537 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 99.29 35.91 4.57 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 110.96 -0.856 . . . . 0.0 110.96 -179.722 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 85.0 mt -99.29 -19.03 17.28 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.746 0.307 . . . . 0.0 110.889 179.818 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.529 HG21 HD13 ' A' ' 67' ' ' LEU . 15.8 m -134.55 157.8 41.45 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.247 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.173 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.455 HG12 ' N ' ' A' ' 78' ' ' GLY . 70.8 t -136.8 156.83 35.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.302 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.669 ' N ' HH12 ' A' ' 71' ' ' ARG . . . -133.29 132.74 6.64 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.856 -0.898 . . . . 0.0 110.856 179.344 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -104.86 102.7 12.22 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.891 0.377 . . . . 0.0 110.467 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.746 ' H ' ' NE ' ' A' ' 80' ' ' ARG . 0.0 OUTLIER -74.27 139.43 44.28 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.197 179.52 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -150.93 145.07 25.36 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.385 178.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -43.2 -32.28 1.61 Allowed Glycine 0 CA--C 1.522 0.511 0 N-CA-C 110.638 -0.985 . . . . 0.0 110.638 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 71.6 ttt180 -73.52 -46.9 45.0 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.89 -0.324 . . . . 0.0 110.783 179.619 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 4.1 m 178.09 178.66 0.35 Allowed 'General case' 0 C--O 1.234 0.274 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 -179.153 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 1.4 tp -105.36 127.47 60.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.657 178.907 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 97.9 t -102.81 118.52 49.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.414 179.043 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 87.0 m-85 -95.52 127.58 41.67 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.38 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 34.5 p -150.15 165.72 32.0 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 116.195 -0.457 . . . . 0.0 109.867 -179.038 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.752 ' N ' HD22 ' A' ' 89' ' ' LEU . 2.5 mm? -67.82 146.52 53.61 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.561 -179.093 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.473 ' C ' ' CD1' ' A' ' 90' ' ' TYR . 16.4 t80 -58.27 -50.03 75.03 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.446 -179.515 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.527 ' OD1' ' N ' ' A' ' 92' ' ' THR . 53.7 t0 -101.0 155.6 17.88 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.473 -179.644 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . 0.527 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 62.8 p -92.99 -24.34 18.39 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 121.104 0.478 . . . . 0.0 110.576 179.503 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -57.47 -47.94 80.52 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.221 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.554 HG13 ' N ' ' A' ' 95' ' ' ALA . 8.0 p -55.05 -44.78 75.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.243 -0.435 . . . . 0.0 109.857 -179.936 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.554 ' N ' HG13 ' A' ' 94' ' ' VAL . . . -56.0 -41.94 75.64 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.039 179.638 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 9.4 tp-100 -61.74 -39.49 91.76 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.071 179.616 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.514 ' CD1' ' HB2' ' B' ' 220' ' ' ALA . 13.5 tp -60.36 -43.51 96.44 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.153 -0.476 . . . . 0.0 109.92 -179.597 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.418 ' O ' HG22 ' A' ' 102' ' ' ILE . 4.1 mm? -64.25 -37.18 86.57 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.302 179.251 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . 0.532 ' OD1' ' NH1' ' A' ' 43' ' ' ARG . 97.2 m-20 -60.65 -39.89 90.0 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.186 0.517 . . . . 0.0 110.378 179.861 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -72.78 -47.24 48.33 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.391 -0.524 . . . . 0.0 110.653 179.4 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.428 ' HB2' ' CD1' ' B' ' 216' ' ' LEU . . . -62.66 -50.94 69.21 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.042 -179.851 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.554 HG23 ' N ' ' A' ' 103' ' ' TYR . 10.7 tp -59.21 -47.13 91.34 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.412 -178.673 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' TYR . . . . . 0.554 ' N ' HG23 ' A' ' 102' ' ' ILE . 79.5 t80 -60.54 -39.55 88.31 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.275 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . 0.482 ' CE1' ' OD2' ' B' ' 210' ' ' ASP . 0.9 OUTLIER -61.19 -41.66 97.19 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.728 179.601 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 33.3 t -73.56 -38.68 65.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.808 179.645 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.514 ' O ' ' CD2' ' A' ' 109' ' ' HIS . 83.7 tt0 -64.78 -34.58 78.67 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.637 -179.508 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 74.6 t60 -79.27 0.81 27.2 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.66 -179.807 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.437 HD23 HE22 ' B' ' 141' ' ' GLN . 36.4 tp -80.09 82.57 6.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.003 0.43 . . . . 0.0 110.399 -179.501 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . 0.514 ' CD2' ' O ' ' A' ' 106' ' ' GLU . 97.0 m-70 -139.54 148.29 42.38 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.653 179.718 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.526 ' N ' HD12 ' A' ' 110' ' ' LEU . 10.7 mp -62.35 -41.86 98.93 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.369 -179.843 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 90.88 92.44 1.3 Allowed Glycine 0 CA--C 1.524 0.649 0 N-CA-C 110.796 -0.921 . . . . 0.0 110.796 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 70.2 mt -74.34 151.97 39.67 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.811 0.339 . . . . 0.0 110.373 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 11.9 p -65.38 154.44 38.38 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.254 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -92.5 107.12 18.97 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.409 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 90.9 mtm-85 -89.92 144.34 26.01 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.382 179.792 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -153.64 70.57 6.64 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.423 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -52.78 -39.9 76.01 Favored 'Trans proline' 0 C--N 1.308 -1.591 0 C-N-CA 122.747 2.298 . . . . 0.0 112.0 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 32.4 t 55.19 64.64 1.72 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.593 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -64.33 -37.21 86.68 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.514 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.717 0 CA-C-O 117.937 -1.48 . . . . 0.0 110.981 -179.987 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.372 0 N-CA-C 109.656 -1.378 . . . . 0.0 109.656 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 78.6 m80 -102.18 123.17 45.56 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.894 0.378 . . . . 0.0 110.434 -179.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 123' ' ' GLY . . . . . . . . . . . . . . . -168.9 159.89 33.14 Favored Glycine 0 CA--C 1.524 0.609 0 N-CA-C 110.863 -0.895 . . . . 0.0 110.863 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 26.1 m -72.12 -23.57 21.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.991 0.424 . . . . 0.0 110.767 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 125' ' ' GLU . . . . . . . . . . . . . 9.7 tm-20 64.23 136.0 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.553 -179.806 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 79.22 18.58 73.98 Favored Glycine 0 CA--C 1.525 0.667 0 N-CA-C 110.885 -0.886 . . . . 0.0 110.885 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 127' ' ' ARG . . . . . . . . . . . . . 52.3 ptt85 -75.62 145.16 41.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.706 0.289 . . . . 0.0 110.528 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 128' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -131.98 127.01 35.39 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.935 0.398 . . . . 0.0 110.322 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 129' ' ' ARG . . . . . . . . . . . . . 56.5 mtp180 -87.67 149.17 45.62 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.593 -179.778 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -70.27 64.79 2.11 Favored 'Trans proline' 0 N--CA 1.495 1.616 0 C-N-CA 122.531 2.154 . . . . 0.0 111.948 179.526 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 33.7 m -71.5 146.42 48.55 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.171 179.887 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 132' ' ' ALA . . . . . 0.666 ' HB1' ' CD ' ' B' ' 133' ' ' PRO . . . 56.3 179.43 0.03 OUTLIER Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.667 179.764 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 133' ' ' PRO . . . . . 0.666 ' CD ' ' HB1' ' B' ' 132' ' ' ALA . 24.1 Cg_exo -62.91 161.83 27.88 Favored 'Trans proline' 0 N--CA 1.492 1.405 0 C-N-CA 123.013 2.475 . . . . 0.0 111.658 178.848 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . 1.039 ' H ' HD22 ' B' ' 134' ' ' LEU . 0.4 OUTLIER -70.6 55.9 0.17 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.781 -179.802 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 95.1 m-20 -96.33 -59.06 1.91 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.679 -0.692 . . . . 0.0 110.384 179.407 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 90.9 p -58.81 -34.13 71.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.39 -179.633 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -67.05 -49.04 66.46 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.377 179.582 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 138' ' ' ALA . . . . . 0.503 ' O ' HG23 ' B' ' 142' ' ' VAL . . . -56.87 -36.76 70.44 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 120.845 -0.342 . . . . 0.0 110.232 -179.872 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 139' ' ' ALA . . . . . 0.405 ' HB1' ' HB3' ' A' ' 36' ' ' LEU . . . -66.22 -53.41 37.47 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.498 179.415 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -59.75 -46.02 90.43 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.907 -179.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 141' ' ' GLN . . . . . 0.437 HE22 HD23 ' A' ' 108' ' ' LEU . 65.2 tt0 -58.14 -51.08 71.19 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.278 0.561 . . . . 0.0 110.385 -179.777 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 142' ' ' VAL . . . . . 0.503 HG23 ' O ' ' B' ' 138' ' ' ALA . 70.8 t -61.66 -44.96 99.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.992 179.703 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -57.36 -42.6 82.34 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 74.9 m -57.36 -44.11 84.09 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 179.823 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 19.7 m -63.99 -48.52 76.09 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.639 179.437 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 146' ' ' LEU . . . . . . . . . . . . . 80.3 mt -63.69 -22.55 66.96 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.498 -179.78 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 147' ' ' GLN . . . . . 0.536 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 58.8 tt0 -75.21 -58.43 3.28 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.679 179.374 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -59.96 -54.32 47.51 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.91 -179.308 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.551 ' O ' ' O ' ' B' ' 150' ' ' ALA . 3.9 mm? -48.65 -30.89 5.95 Favored 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 -179.076 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 150' ' ' ALA . . . . . 0.551 ' O ' ' O ' ' B' ' 149' ' ' LEU . . . -56.37 -134.47 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 120.465 -0.494 . . . . 0.0 110.52 179.175 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 151' ' ' THR . . . . . 0.493 ' O ' ' O ' ' B' ' 150' ' ' ALA . 12.3 p 53.62 115.83 0.01 OUTLIER Pre-proline 0 C--N 1.32 -0.677 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.779 -179.804 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_exo -49.07 -44.27 33.47 Favored 'Trans proline' 0 N--CA 1.497 1.701 0 C-N-CA 122.118 1.879 . . . . 0.0 112.991 -179.742 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 6.9 t -59.11 -46.21 88.9 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.94 -178.859 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 16.0 tpp180 -62.96 -36.8 84.67 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.425 -179.715 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 155' ' ' LEU . . . . . 0.464 ' O ' HG23 ' B' ' 159' ' ' THR . 1.9 mm? -62.88 -54.11 43.81 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.384 -0.526 . . . . 0.0 110.821 -179.09 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 156' ' ' MET . . . . . 0.455 ' O ' ' OG1' ' B' ' 159' ' ' THR . 0.0 OUTLIER -57.72 -49.34 76.89 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.063 -0.655 . . . . 0.0 110.614 -179.416 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 157' ' ' ILE . . . . . 0.401 HD13 ' HA ' ' B' ' 157' ' ' ILE . 39.0 mm -62.63 -42.71 97.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-O 121.218 0.533 . . . . 0.0 110.337 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 48.6 tp -62.22 -43.03 99.74 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.769 -179.787 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 159' ' ' THR . . . . . 0.464 HG23 ' O ' ' B' ' 155' ' ' LEU . 23.4 p -60.52 -37.08 80.0 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.913 -0.403 . . . . 0.0 109.913 -179.455 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 75.7 mt-30 -62.71 -46.13 89.57 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.256 -0.577 . . . . 0.0 110.037 179.142 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 161' ' ' LEU . . . . . . . . . . . . . 98.2 mt -64.79 -42.87 94.72 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 120.786 -0.365 . . . . 0.0 110.908 179.63 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 162' ' ' ARG . . . . . 0.525 ' NH1' ' OD1' ' B' ' 218' ' ' ASP . 68.4 ttp85 -51.73 -18.24 1.17 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.395 -179.799 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 61.1 t30 -75.26 -75.05 0.18 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.676 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . -178.42 -141.99 4.55 Favored Glycine 0 CA--C 1.534 1.225 0 C-N-CA 120.487 -0.863 . . . . 0.0 111.199 -179.65 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -49.25 132.77 29.22 Favored 'Trans proline' 0 N--CA 1.493 1.477 0 C-N-CA 122.149 1.899 . . . . 0.0 112.338 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 166' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -138.3 67.48 46.37 Favored Pre-proline 0 CA--C 1.536 0.416 0 CA-C-O 121.558 0.694 . . . . 0.0 111.362 -179.856 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -51.97 147.93 24.79 Favored 'Trans proline' 0 C--N 1.298 -2.082 0 C-N-CA 121.772 1.648 . . . . 0.0 111.347 178.24 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . 22.1 t -53.17 -50.39 46.46 Favored 'Isoleucine or valine' 0 C--O 1.237 0.417 0 CA-C-O 121.162 0.505 . . . . 0.0 110.556 -178.296 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 169' ' ' THR . . . . . . . . . . . . . 59.1 p -63.97 -37.8 88.73 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.477 179.274 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -63.57 -41.2 98.4 Favored 'General case' 0 CA--C 1.513 -0.455 0 CA-C-O 121.249 0.547 . . . . 0.0 109.987 179.191 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 171' ' ' LEU . . . . . 0.7 ' C ' HD13 ' B' ' 171' ' ' LEU . 2.8 tm? -61.95 -46.83 87.58 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 119.706 -0.798 . . . . 0.0 109.96 -179.628 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 172' ' ' ALA . . . . . 0.513 ' O ' ' N ' ' B' ' 176' ' ' GLY . . . -52.49 -47.85 66.31 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 120.558 -0.457 . . . . 0.0 109.955 179.441 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 44.7 tp10 -54.81 -48.5 72.7 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.425 -0.51 . . . . 0.0 110.531 179.669 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -56.32 -54.93 39.59 Favored 'General case' 0 C--O 1.232 0.157 0 C-N-CA 120.581 -0.448 . . . . 0.0 110.959 -179.352 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 175' ' ' ILE . . . . . . . . . . . . . 96.3 mt -88.89 -73.91 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.398 179.706 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 176' ' ' GLY . . . . . 0.513 ' N ' ' O ' ' B' ' 172' ' ' ALA . . . 132.24 97.53 0.69 Allowed Glycine 0 CA--C 1.523 0.534 0 N-CA-C 111.405 -0.678 . . . . 0.0 111.405 179.824 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 78.3 mtm 58.09 78.06 0.26 Allowed 'General case' 0 CA--C 1.521 -0.148 0 C-N-CA 121.04 -0.264 . . . . 0.0 110.947 179.141 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 178' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -174.19 32.23 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.02 0.438 . . . . 0.0 110.115 179.676 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 179' ' ' GLN . . . . . 0.621 ' H ' ' CD ' ' B' ' 179' ' ' GLN . 0.0 OUTLIER -82.21 -25.68 33.98 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.514 -179.017 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 180' ' ' SER . . . . . 0.526 ' O ' ' ND1' ' B' ' 184' ' ' HIS . 34.3 m -65.49 -42.98 91.57 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.589 -179.916 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -69.0 -36.91 78.34 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.633 179.826 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 54.5 t -69.8 -51.84 36.97 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.279 0 C-N-CA 120.501 -0.48 . . . . 0.0 110.785 179.791 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 48.0 t -60.05 -44.94 94.33 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.277 -0.569 . . . . 0.0 110.583 179.606 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 184' ' ' HIS . . . . . 0.588 ' CG ' HH21 ' B' ' 187' ' ' ARG . 0.9 OUTLIER -56.92 -47.61 80.19 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.395 -179.797 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -58.42 -43.07 88.51 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.967 179.699 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 186' ' ' LEU . . . . . 0.519 HD13 HG21 ' B' ' 195' ' ' VAL . 3.3 mm? -60.53 -43.96 96.58 Favored 'General case' 0 CA--C 1.511 -0.535 0 C-N-CA 120.646 -0.421 . . . . 0.0 110.558 -179.723 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 187' ' ' ARG . . . . . 0.588 HH21 ' CG ' ' B' ' 184' ' ' HIS . 86.9 mtm180 -61.32 -40.65 94.98 Favored 'General case' 0 C--N 1.312 -1.043 0 C-N-CA 120.46 -0.496 . . . . 0.0 110.463 -180.0 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 188' ' ' VAL . . . . . 0.494 HG23 ' O ' ' B' ' 184' ' ' HIS . 97.3 t -59.15 -52.36 61.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 C-N-CA 120.352 -0.539 . . . . 0.0 109.701 -179.533 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 189' ' ' LEU . . . . . 0.437 ' N ' HD12 ' B' ' 189' ' ' LEU . 10.9 mp -67.18 -31.81 72.46 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.954 0.407 . . . . 0.0 110.341 179.078 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 190' ' ' ARG . . . . . 0.666 HH12 ' N ' ' B' ' 197' ' ' GLY . 9.6 tpt180 -54.44 -43.49 71.65 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.867 -179.137 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 10.9 m120 -61.0 -43.59 98.67 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.329 -0.549 . . . . 0.0 110.283 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 192' ' ' LEU . . . . . . . . . . . . . 10.7 mt -64.75 -39.09 93.05 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.948 0.404 . . . . 0.0 110.359 179.815 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 99.12 35.43 4.78 Favored Glycine 0 CA--C 1.524 0.621 0 N-CA-C 111.056 -0.818 . . . . 0.0 111.056 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 17.5 mt -98.7 -18.43 18.04 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.866 0.365 . . . . 0.0 110.773 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 195' ' ' VAL . . . . . 0.519 HG21 HD13 ' B' ' 186' ' ' LEU . 14.1 m -134.39 157.75 41.6 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.268 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.003 -179.912 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 196' ' ' VAL . . . . . 0.484 HG12 ' N ' ' B' ' 197' ' ' GLY . 60.8 t -137.98 158.06 32.77 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.239 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.265 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 197' ' ' GLY . . . . . 0.666 ' N ' HH12 ' B' ' 190' ' ' ARG . . . -135.75 132.69 6.27 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 179.37 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 9.7 t0 -103.47 103.87 13.89 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.865 0.364 . . . . 0.0 110.572 179.763 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 199' ' ' ARG . . . . . 0.727 ' H ' ' NE ' ' B' ' 199' ' ' ARG . 0.0 OUTLIER -74.12 139.8 44.8 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.955 179.46 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 200' ' ' ALA . . . . . . . . . . . . . . . -151.09 144.46 24.84 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 120.566 -0.454 . . . . 0.0 110.338 178.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 201' ' ' GLY . . . . . . . . . . . . . . . -42.84 -33.22 1.58 Allowed Glycine 0 CA--C 1.524 0.597 0 N-CA-C 110.589 -1.004 . . . . 0.0 110.589 -179.805 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 202' ' ' ARG . . . . . . . . . . . . . 72.8 ttt180 -72.7 -46.28 54.5 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.696 179.76 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 3.5 m 177.6 178.76 0.3 Allowed 'General case' 0 N--CA 1.455 -0.222 0 CA-C-O 121.06 0.457 . . . . 0.0 109.854 -179.077 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 1.4 tp -105.97 126.75 61.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.58 179.094 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 89.2 t -102.14 118.5 49.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.41 178.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 206' ' ' TYR . . . . . . . . . . . . . 89.9 m-85 -94.98 127.74 41.26 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.384 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 30.4 p -150.33 165.53 32.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.879 -179.042 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 208' ' ' LEU . . . . . 0.739 HD22 ' N ' ' B' ' 208' ' ' LEU . 2.6 mm? -67.3 147.84 52.45 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.898 -179.186 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 209' ' ' TYR . . . . . 0.469 ' C ' ' CD1' ' B' ' 209' ' ' TYR . 17.0 t80 -59.05 -49.22 78.73 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.405 -179.662 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 210' ' ' ASP . . . . . 0.529 ' OD1' ' N ' ' B' ' 211' ' ' THR . 53.5 t0 -102.63 155.7 18.12 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.602 -179.596 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 211' ' ' THR . . . . . 0.529 ' N ' ' OD1' ' B' ' 210' ' ' ASP . 23.8 p -92.78 -24.24 18.61 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.005 0.431 . . . . 0.0 110.348 179.629 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 212' ' ' HIS . . . . . . . . . . . . . 88.3 m-70 -57.15 -48.14 79.43 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.204 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 213' ' ' VAL . . . . . 0.557 HG13 ' N ' ' B' ' 214' ' ' ALA . 9.6 p -55.35 -44.93 77.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 N-CA-C 109.862 -0.422 . . . . 0.0 109.862 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 214' ' ' ALA . . . . . 0.557 ' N ' HG13 ' B' ' 213' ' ' VAL . . . -54.98 -42.86 72.96 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.186 179.583 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 9.6 tp-100 -61.68 -39.67 92.26 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.093 179.545 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 216' ' ' LEU . . . . . 0.428 ' CD1' ' HB2' ' A' ' 101' ' ' ALA . 15.2 tp -59.89 -43.36 94.85 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.585 -0.446 . . . . 0.0 109.883 -179.489 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 217' ' ' LEU . . . . . 0.444 ' O ' HG22 ' B' ' 221' ' ' ILE . 4.2 mm? -64.32 -37.73 88.53 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.408 179.193 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 218' ' ' ASP . . . . . 0.525 ' OD1' ' NH1' ' B' ' 162' ' ' ARG . 98.6 m-20 -60.44 -39.78 88.75 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.122 0.487 . . . . 0.0 110.408 -179.735 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 219' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -72.84 -47.43 46.31 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.496 -0.482 . . . . 0.0 110.696 179.366 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 220' ' ' ALA . . . . . 0.514 ' HB2' ' CD1' ' A' ' 97' ' ' LEU . . . -62.85 -51.11 68.3 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.888 0.375 . . . . 0.0 111.19 -179.847 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 221' ' ' ILE . . . . . 0.558 HG23 ' N ' ' B' ' 222' ' ' TYR . 10.9 tp -58.65 -47.13 89.69 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.363 -178.931 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 222' ' ' TYR . . . . . 0.558 ' N ' HG23 ' B' ' 221' ' ' ILE . 89.1 t80 -60.24 -39.7 87.64 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.258 179.863 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 223' ' ' HIS . . . . . 0.514 ' CE1' ' OD2' ' A' ' 91' ' ' ASP . 0.9 OUTLIER -60.89 -41.91 96.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.979 179.659 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 6.2 t -73.58 -38.34 65.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.923 0.392 . . . . 0.0 110.889 179.589 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 225' ' ' GLU . . . . . 0.481 ' O ' ' CD2' ' B' ' 228' ' ' HIS . 80.1 tt0 -64.82 -35.14 80.15 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.681 -179.504 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 76.6 t60 -79.2 1.37 24.87 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.649 -179.839 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 227' ' ' LEU . . . . . 0.422 HD23 HE22 ' A' ' 22' ' ' GLN . 36.1 tp -80.43 82.16 6.53 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.466 -179.386 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 228' ' ' HIS . . . . . 0.481 ' CD2' ' O ' ' B' ' 225' ' ' GLU . 95.9 m-70 -138.39 149.52 45.62 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.55 179.754 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 229' ' ' LEU . . . . . 0.613 ' N ' HD12 ' B' ' 229' ' ' LEU . 9.5 mp -63.15 -41.93 99.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.262 -179.689 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . 92.25 93.31 1.41 Allowed Glycine 0 CA--C 1.526 0.738 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 -179.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 231' ' ' LEU . . . . . . . . . . . . . 69.1 mt -76.2 148.31 37.8 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.765 0.317 . . . . 0.0 110.539 -179.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 232' ' ' SER . . . . . . . . . . . . . 91.4 p -62.83 154.17 30.78 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.34 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 233' ' ' ASP . . . . . . . . . . . . . 97.1 m-20 -93.01 108.03 19.69 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.263 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 234' ' ' ARG . . . . . . . . . . . . . 89.7 mtm-85 -90.58 143.21 26.96 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.398 179.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 235' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -151.54 70.57 8.16 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.445 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 236' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -53.21 -39.09 81.75 Favored 'Trans proline' 0 C--N 1.307 -1.652 0 C-N-CA 122.84 2.36 . . . . 0.0 112.014 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 237' ' ' SER . . . . . . . . . . . . . 37.6 t 54.23 65.77 1.42 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.399 -179.914 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 238' ' ' ALA . . . . . . . . . . . . . . . -64.44 -36.71 85.07 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.567 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.746 0 CA-C-O 117.963 -1.465 . . . . 0.0 110.933 179.991 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.25 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 50.13 87.65 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.833 0.349 . . . . 0.0 110.701 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 81.9 -3.1 81.47 Favored Glycine 0 CA--C 1.523 0.538 0 N-CA-C 111.018 -0.833 . . . . 0.0 111.018 179.849 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 92.1 t -127.75 130.85 70.27 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 CA-C-O 120.891 0.376 . . . . 0.0 110.407 179.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 44.58 26.47 0.18 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.568 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -61.0 -40.84 99.06 Favored Glycine 0 CA--C 1.522 0.512 0 N-CA-C 110.926 -0.869 . . . . 0.0 110.926 -179.755 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 61.6 ttt85 -117.43 104.83 11.49 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 179.758 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 59.9 t-20 -96.93 112.69 24.33 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.523 179.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 61.4 mtp180 -89.27 147.78 39.11 Favored Pre-proline 0 CA--C 1.536 0.432 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.504 -179.585 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -44.05 134.6 8.35 Favored 'Trans proline' 0 N--CA 1.492 1.387 0 C-N-CA 122.276 1.984 . . . . 0.0 112.28 179.268 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.457 ' O ' ' O ' ' A' ' 13' ' ' ALA . 48.1 t -152.45 142.66 22.4 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.441 179.923 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.457 ' O ' ' O ' ' A' ' 12' ' ' SER . . . 56.84 150.81 0.06 OUTLIER Pre-proline 0 CA--C 1.542 0.663 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.858 179.926 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.439 ' C ' ' H ' ' A' ' 16' ' ' ASP . 61.5 Cg_endo -73.13 153.15 51.58 Favored 'Trans proline' 0 C--N 1.31 -1.455 0 C-N-CA 122.504 2.136 . . . . 0.0 112.018 179.0 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.649 ' N ' HD12 ' A' ' 15' ' ' LEU . 5.7 mp -78.02 32.99 0.18 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.432 179.74 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.439 ' H ' ' C ' ' A' ' 14' ' ' PRO . 97.8 m-20 -96.56 -59.74 1.75 Allowed 'General case' 0 C--O 1.238 0.461 0 CA-C-O 121.321 0.581 . . . . 0.0 111.022 179.012 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 87.8 p -57.66 -33.11 67.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.271 -179.646 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 94.1 mm-40 -67.14 -50.73 60.25 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.282 179.752 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.471 ' O ' HG23 ' A' ' 23' ' ' VAL . . . -56.05 -34.83 66.26 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.031 -179.656 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.66 -53.09 24.5 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 121.275 0.56 . . . . 0.0 110.422 179.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.96 -46.18 90.25 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.246 179.845 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.477 ' N ' ' OE1' ' A' ' 22' ' ' GLN . 0.9 OUTLIER -60.09 -52.26 66.13 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.037 0.446 . . . . 0.0 110.606 -179.574 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.471 HG23 ' O ' ' A' ' 19' ' ' ALA . 77.5 t -62.3 -46.91 95.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 C-N-CA 120.457 -0.497 . . . . 0.0 110.06 -179.934 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -50.47 -47.91 56.87 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-O 120.99 0.424 . . . . 0.0 110.224 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.5 t -59.38 -42.84 92.58 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.342 179.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 95.0 m -61.42 -51.2 69.73 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.766 -179.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.45 ' N ' ' CD1' ' A' ' 27' ' ' LEU . 7.6 mp -67.17 -22.14 65.77 Favored 'General case' 0 CA--C 1.523 -0.075 0 CA-C-O 120.763 0.316 . . . . 0.0 110.645 179.759 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.498 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 7.8 tt0 -71.26 -62.48 1.39 Allowed 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.526 179.112 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.414 ' HB1' ' NH1' ' A' ' 35' ' ' ARG . . . -57.25 -53.68 55.42 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 120.753 -0.379 . . . . 0.0 110.591 -179.346 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.493 ' O ' ' O ' ' A' ' 31' ' ' ALA . 85.7 mt -46.54 -31.4 2.75 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.417 -178.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.498 ' HB3' ' O ' ' A' ' 28' ' ' GLN . . . -57.06 -127.87 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.423 0 O-C-N 123.667 0.604 . . . . 0.0 110.339 179.522 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.43 ' O ' ' O ' ' A' ' 31' ' ' ALA . 0.5 OUTLIER 53.88 108.26 0.02 OUTLIER Pre-proline 0 CA--C 1.544 0.738 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.592 179.973 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -48.48 -56.01 3.54 Favored 'Trans proline' 0 N--CA 1.494 1.535 0 C-N-CA 122.061 1.841 . . . . 0.0 113.282 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 79.9 p -59.88 -46.19 90.1 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.097 -178.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.418 ' HB3' ' HG1' ' A' ' 32' ' ' THR . 35.5 ttm180 -62.78 -43.4 98.91 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.426 -179.786 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.56 HD23 ' O ' ' A' ' 36' ' ' LEU . 1.9 tt -61.46 -53.37 57.4 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.675 -178.785 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.606 ' CE ' HE21 ' A' ' 41' ' ' GLN . 11.0 tpt -51.55 -48.74 62.97 Favored 'General case' 0 C--O 1.242 0.66 0 C-N-CA 120.338 -0.545 . . . . 0.0 110.419 -179.788 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 96.6 mt -60.8 -46.48 96.07 Favored 'Isoleucine or valine' 0 C--O 1.243 0.72 0 CA-C-O 121.545 0.688 . . . . 0.0 110.375 -179.264 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 72.6 mt -59.98 -41.4 91.92 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.14 179.813 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 13.8 m -55.48 -43.08 75.21 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.119 179.698 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.606 HE21 ' CE ' ' A' ' 37' ' ' MET . 99.2 mm-40 -61.52 -44.21 97.47 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.401 -0.52 . . . . 0.0 110.72 179.676 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.569 HD11 ' O ' ' A' ' 87' ' ' TYR . 13.7 tp -68.57 -44.3 74.75 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.335 -0.546 . . . . 0.0 111.323 180.0 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 89.3 mtm-85 -49.18 -17.14 0.2 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.322 -178.879 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.417 ' N ' ' C ' ' A' ' 42' ' ' LEU . 60.9 t-20 -147.06 65.22 1.16 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.086 179.795 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 159.29 82.01 0.04 OUTLIER Glycine 0 CA--C 1.529 0.937 0 N-CA-C 111.121 -0.792 . . . . 0.0 111.121 -179.866 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_exo -69.77 113.34 3.34 Favored 'Trans proline' 0 N--CA 1.497 1.711 0 C-N-CA 123.172 2.581 . . . . 0.0 111.061 178.786 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.554 HD12 ' O ' ' A' ' 47' ' ' LEU . 0.3 OUTLIER -167.15 158.61 10.48 Favored Pre-proline 0 C--N 1.324 -0.531 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.544 -179.171 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -62.71 -171.59 0.11 Allowed 'Trans proline' 0 N--CA 1.497 1.68 0 C-N-CA 122.667 2.245 . . . . 0.0 112.052 178.756 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.548 ' O ' ' N ' ' A' ' 52' ' ' LEU . 46.4 t -75.69 -62.99 1.13 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.353 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.509 -179.918 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.431 ' C ' ' O ' ' A' ' 49' ' ' VAL . 14.5 m -34.7 -49.32 0.41 Allowed 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 121.184 0.516 . . . . 0.0 110.597 -179.268 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -61.79 -44.32 97.12 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.275 178.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.61 HD23 ' O ' ' A' ' 52' ' ' LEU . 1.3 tt -62.47 -38.67 90.73 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.773 -179.919 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.12 -42.02 93.86 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.047 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -62.66 -43.96 97.48 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.134 179.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.99 -54.95 22.4 Favored 'General case' 0 C--N 1.332 -0.159 0 C-N-CA 120.584 -0.446 . . . . 0.0 110.951 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.682 HG23 ' O ' ' A' ' 56' ' ' ILE . 6.8 tt -176.75 86.45 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.456 -0.133 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.761 -179.863 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . 0.508 ' O ' ' N ' ' A' ' 59' ' ' GLU . . . -157.6 -49.79 0.01 OUTLIER Glycine 0 CA--C 1.523 0.544 0 N-CA-C 110.425 -1.07 . . . . 0.0 110.425 178.608 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 99.6 mtp 43.0 17.86 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.747 0.308 . . . . 0.0 110.745 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.508 ' N ' ' O ' ' A' ' 57' ' ' GLY . 95.8 mt-10 -148.31 68.61 1.09 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.152 0.501 . . . . 0.0 109.725 -179.374 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 8.7 mt-30 -58.46 -36.32 73.52 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.798 -179.397 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 37.7 t -62.15 -45.35 93.81 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.777 -179.749 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -61.89 -36.22 80.64 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.293 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 94.0 t -65.41 -50.7 71.21 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 C-N-CA 120.657 -0.417 . . . . 0.0 110.587 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.4 t -57.74 -45.98 85.1 Favored 'General case' 0 C--N 1.332 -0.165 0 C-N-CA 120.722 -0.391 . . . . 0.0 110.331 -179.275 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 48.8 m170 -61.65 -48.0 82.81 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-O 121.191 0.52 . . . . 0.0 110.618 179.803 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 44.5 tt0 -61.83 -40.11 94.14 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.217 -179.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.6 tp -62.39 -43.27 99.21 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.232 -179.472 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -60.7 -42.92 98.13 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 120.827 -0.349 . . . . 0.0 110.732 -179.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 95.8 t -64.88 -54.19 32.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 C-N-CA 119.898 -0.721 . . . . 0.0 110.674 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 96.6 mt -59.48 -40.34 86.67 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 -178.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 62.2 ttp180 -57.97 -41.42 82.91 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.218 179.703 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -58.04 -48.62 79.54 Favored 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 120.596 -0.441 . . . . 0.0 110.539 -179.585 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.536 HD22 ' N ' ' A' ' 73' ' ' LEU . 4.0 mm? -66.36 -41.08 89.98 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.63 179.544 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . 0.433 ' C ' HD12 ' A' ' 75' ' ' LEU . . . 107.42 38.83 2.03 Favored Glycine 0 CA--C 1.525 0.671 0 N-CA-C 111.089 -0.805 . . . . 0.0 111.089 -179.812 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.496 ' N ' HD12 ' A' ' 75' ' ' LEU . 9.9 mp -98.86 -13.22 20.16 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 110.446 -0.205 . . . . 0.0 110.446 179.43 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 23.1 m -136.33 155.53 34.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.404 HG23 ' HA ' ' A' ' 90' ' ' TYR . 24.8 t -139.84 150.23 22.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.663 179.847 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -110.67 158.11 14.59 Favored Glycine 0 CA--C 1.523 0.552 0 N-CA-C 110.153 -1.179 . . . . 0.0 110.153 178.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -131.47 146.86 52.44 Favored 'General case' 0 CA--C 1.515 -0.378 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 -179.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 62.3 ttp180 -111.5 137.97 48.63 Favored 'General case' 0 N--CA 1.468 0.428 0 O-C-N 123.513 0.508 . . . . 0.0 110.411 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -147.85 128.78 14.44 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.409 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 48.13 -99.1 0.02 OUTLIER Glycine 0 CA--C 1.523 0.534 0 N-CA-C 110.776 -0.93 . . . . 0.0 110.776 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 66.5 ttt-85 -132.29 45.43 2.76 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.066 0.46 . . . . 0.0 110.145 -179.801 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 88.8 p -163.53 164.12 24.4 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 121.009 0.433 . . . . 0.0 109.938 -179.855 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.622 HD11 ' CZ ' ' A' ' 87' ' ' TYR . 1.0 OUTLIER -140.01 156.93 25.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.549 179.603 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.578 ' N ' HD12 ' A' ' 85' ' ' ILE . 15.5 m -133.92 156.64 41.33 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.394 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.324 179.2 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.622 ' CZ ' HD11 ' A' ' 85' ' ' ILE . 77.5 m-85 -108.03 136.56 47.52 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.279 -179.729 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 47.5 t -150.63 170.03 20.16 Favored 'General case' 0 CA--C 1.514 -0.439 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.428 ' N ' HD22 ' A' ' 89' ' ' LEU . 4.4 mm? -61.66 153.26 28.57 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.737 179.259 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.404 ' HA ' HG23 ' A' ' 77' ' ' VAL . 65.5 t80 -50.51 -45.83 56.83 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.485 179.953 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.498 ' OD2' ' CG ' ' A' ' 93' ' ' HIS . 28.3 t70 -156.88 168.41 27.55 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.937 -0.305 . . . . 0.0 110.507 179.88 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . 0.538 ' O ' ' HB3' ' A' ' 95' ' ' ALA . 64.1 p -68.88 -32.28 71.82 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.838 -179.999 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . 0.498 ' CG ' ' OD2' ' A' ' 91' ' ' ASP . 27.3 m170 -39.46 -67.79 0.2 Allowed 'General case' 0 C--O 1.24 0.56 0 CA-C-O 121.34 0.591 . . . . 0.0 110.716 -179.9 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 57.7 t -45.73 -40.42 3.22 Favored 'Isoleucine or valine' 0 C--O 1.236 0.395 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.32 179.744 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.538 ' HB3' ' O ' ' A' ' 92' ' ' THR . . . -61.49 -38.09 86.04 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.31 -179.989 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -60.74 -44.99 95.98 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.303 0.573 . . . . 0.0 110.028 -179.653 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.518 ' N ' ' CD1' ' A' ' 97' ' ' LEU . 6.4 mp -61.51 -46.32 90.48 Favored 'General case' 0 C--O 1.24 0.592 0 CA-C-O 121.522 0.677 . . . . 0.0 110.193 -179.467 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 17.7 mt -66.61 -33.86 76.59 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.259 179.494 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 91.7 m-20 -59.87 -42.48 93.78 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 -179.597 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -65.45 -48.68 71.85 Favored 'General case' 0 N--CA 1.462 0.149 0 N-CA-C 109.819 -0.438 . . . . 0.0 109.819 179.458 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.26 -44.82 96.63 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.946 179.439 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 5.3 mm -63.63 -46.17 95.56 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.932 -179.824 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 90.2 t80 -63.78 -50.78 67.65 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 120.711 -0.396 . . . . 0.0 110.643 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 56.7 t-80 -59.93 -33.9 72.51 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.677 -179.617 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 7.5 t -76.06 -50.37 14.93 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.866 0.365 . . . . 0.0 111.323 179.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -64.81 -22.03 66.9 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.534 -179.733 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 34.5 t60 -60.22 -73.31 0.09 Allowed 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 120.551 -0.46 . . . . 0.0 110.524 -179.048 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 45.1 mt -79.87 -45.25 18.98 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.018 0.437 . . . . 0.0 110.447 179.779 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 51.2 t-80 43.93 51.62 6.89 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.757 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 70.6 mt -63.33 -42.41 98.96 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.702 -179.827 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 88.32 -106.32 3.23 Favored Glycine 0 CA--C 1.524 0.628 0 N-CA-C 111.041 -0.824 . . . . 0.0 111.041 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.589 HD12 ' N ' ' A' ' 112' ' ' LEU . 10.0 mp 43.94 60.22 2.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.851 0.358 . . . . 0.0 110.514 -179.754 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 69.0 m -60.79 -41.29 95.32 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.346 179.841 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 52.11 28.05 5.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.455 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 -142.92 11.93 1.83 Allowed 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.711 -179.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . 0.625 ' N ' ' CD ' ' A' ' 117' ' ' PRO . 0.8 OUTLIER -64.84 -42.38 62.73 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.355 179.787 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . 0.625 ' CD ' ' N ' ' A' ' 116' ' ' HIS . 36.9 Cg_exo -59.9 143.01 99.65 Favored 'Trans proline' 0 C--N 1.309 -1.544 0 C-N-CA 122.499 2.133 . . . . 0.0 111.86 -179.241 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 41.6 m -61.09 -41.54 96.86 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.508 179.635 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . 48.28 94.54 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.543 -179.82 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.772 0 CA-C-O 118.006 -1.441 . . . . 0.0 110.982 -179.914 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.29 0 N-CA-C 109.489 -1.444 . . . . 0.0 109.489 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 47.57 86.55 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.883 0.373 . . . . 0.0 110.713 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 123' ' ' GLY . . . . . . . . . . . . . . . 82.32 -5.68 71.62 Favored Glycine 0 CA--C 1.522 0.471 0 N-CA-C 111.0 -0.84 . . . . 0.0 111.0 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 76.5 t -125.3 130.33 72.95 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.375 0 CA-C-O 120.792 0.33 . . . . 0.0 110.215 179.917 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 125' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 45.24 26.87 0.29 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.491 179.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -62.01 -41.22 99.66 Favored Glycine 0 CA--C 1.523 0.562 0 N-CA-C 110.987 -0.845 . . . . 0.0 110.987 -179.813 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 127' ' ' ARG . . . . . . . . . . . . . 61.6 ttt85 -117.1 106.64 13.58 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.855 0.36 . . . . 0.0 110.058 179.762 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 128' ' ' ASN . . . . . . . . . . . . . 61.3 t-20 -100.01 114.65 28.1 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.465 -179.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 129' ' ' ARG . . . . . . . . . . . . . 60.6 mtp180 -92.07 147.22 34.31 Favored Pre-proline 0 CA--C 1.536 0.416 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.252 -179.561 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -44.42 135.99 8.8 Favored 'Trans proline' 0 N--CA 1.491 1.35 0 C-N-CA 122.346 2.031 . . . . 0.0 112.532 179.491 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 131' ' ' SER . . . . . 0.449 ' O ' ' O ' ' B' ' 132' ' ' ALA . 46.7 t -155.62 142.3 18.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.406 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 132' ' ' ALA . . . . . 0.449 ' O ' ' O ' ' B' ' 131' ' ' SER . . . 56.69 150.16 0.06 OUTLIER Pre-proline 0 CA--C 1.543 0.706 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.124 179.936 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 133' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -73.46 149.1 43.94 Favored 'Trans proline' 0 C--N 1.311 -1.422 0 C-N-CA 122.418 2.079 . . . . 0.0 112.101 179.001 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . 0.666 ' N ' HD12 ' B' ' 134' ' ' LEU . 6.5 mp -63.69 -39.02 93.29 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.478 179.675 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 135' ' ' ASP . . . . . 0.422 ' C ' ' O ' ' B' ' 134' ' ' LEU . 97.9 m-20 -32.49 -55.38 0.34 Allowed 'General case' 0 N--CA 1.469 0.477 0 O-C-N 123.621 0.576 . . . . 0.0 111.056 -178.715 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . . . . . . . . . 77.5 p -56.77 -45.66 81.96 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.176 179.237 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 137' ' ' GLN . . . . . 0.522 ' N ' ' O ' ' B' ' 134' ' ' LEU . 95.5 mm-40 -62.56 -45.73 91.57 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.306 -179.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 138' ' ' ALA . . . . . 0.523 ' O ' HG23 ' B' ' 142' ' ' VAL . . . -56.64 -34.29 67.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.277 -179.886 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.7 -53.26 23.22 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-O 121.045 0.45 . . . . 0.0 110.419 179.394 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -60.17 -46.65 88.96 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 120.604 -0.438 . . . . 0.0 111.356 179.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 141' ' ' GLN . . . . . 0.511 ' N ' ' OE1' ' B' ' 141' ' ' GLN . 0.8 OUTLIER -59.29 -52.57 65.07 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.114 0.483 . . . . 0.0 110.767 -179.439 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 142' ' ' VAL . . . . . 0.523 HG23 ' O ' ' B' ' 138' ' ' ALA . 96.7 t -62.05 -47.09 94.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 C-N-CA 120.395 -0.522 . . . . 0.0 110.113 -179.8 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -50.85 -47.26 60.32 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 120.931 0.396 . . . . 0.0 110.322 -179.649 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 14.4 t -59.28 -42.33 90.99 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.019 179.78 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 96.4 m -62.57 -51.61 66.66 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.406 -0.518 . . . . 0.0 110.806 -179.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 146' ' ' LEU . . . . . 0.423 ' N ' ' CD1' ' B' ' 146' ' ' LEU . 7.8 mp -66.24 -22.62 66.33 Favored 'General case' 0 CA--C 1.523 -0.096 0 CA-C-O 120.807 0.337 . . . . 0.0 110.653 179.602 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 147' ' ' GLN . . . . . 0.495 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 7.8 tt0 -70.89 -63.28 1.13 Allowed 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.593 179.262 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -56.85 -53.28 59.71 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 120.691 -0.404 . . . . 0.0 110.924 -179.297 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.494 ' O ' ' O ' ' B' ' 150' ' ' ALA . 88.9 mt -46.5 -31.0 2.47 Favored 'General case' 0 CA--C 1.511 -0.548 0 C-N-CA 120.956 -0.298 . . . . 0.0 110.503 -179.106 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 150' ' ' ALA . . . . . 0.495 ' HB3' ' O ' ' B' ' 147' ' ' GLN . . . -57.57 -128.58 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.454 0 O-C-N 123.54 0.525 . . . . 0.0 110.517 179.511 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 151' ' ' THR . . . . . 0.436 ' O ' ' O ' ' B' ' 150' ' ' ALA . 0.6 OUTLIER 53.81 107.39 0.02 OUTLIER Pre-proline 0 CA--C 1.543 0.677 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.554 179.946 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -47.9 -59.25 1.32 Allowed 'Trans proline' 0 N--CA 1.494 1.533 0 C-N-CA 122.122 1.881 . . . . 0.0 113.338 -179.811 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 78.2 p -56.6 -46.6 80.78 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.055 -178.76 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 154' ' ' ARG . . . . . 0.401 ' HB3' ' HG1' ' B' ' 151' ' ' THR . 36.1 ttm180 -62.4 -43.33 99.07 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.451 179.795 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 155' ' ' LEU . . . . . 0.53 HD23 ' O ' ' B' ' 155' ' ' LEU . 1.8 tt -61.05 -53.88 51.75 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 120.468 -0.493 . . . . 0.0 110.582 -178.733 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 156' ' ' MET . . . . . 0.581 ' CE ' HE21 ' B' ' 160' ' ' GLN . 11.0 tpt -51.16 -48.86 61.78 Favored 'General case' 0 C--O 1.24 0.584 0 C-N-CA 120.178 -0.609 . . . . 0.0 110.425 -179.741 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 96.3 mt -59.94 -47.33 92.07 Favored 'Isoleucine or valine' 0 C--O 1.244 0.785 0 CA-C-O 121.715 0.769 . . . . 0.0 110.29 -179.417 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 158' ' ' LEU . . . . . . . . . . . . . 75.3 mt -59.11 -41.89 89.24 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.053 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 13.6 m -54.77 -43.53 72.88 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.354 179.718 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 160' ' ' GLN . . . . . 0.581 HE21 ' CE ' ' B' ' 156' ' ' MET . 98.9 mm-40 -60.72 -44.68 96.32 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.393 -0.523 . . . . 0.0 110.574 179.725 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 161' ' ' LEU . . . . . 0.589 HD11 ' O ' ' B' ' 206' ' ' TYR . 13.4 tp -68.43 -43.73 76.47 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.351 -0.54 . . . . 0.0 111.401 179.887 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 162' ' ' ARG . . . . . . . . . . . . . 88.5 mtm-85 -50.04 -19.63 0.77 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.355 -178.8 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 55.3 t-20 -142.89 64.81 1.35 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.057 179.836 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . 156.81 88.72 0.07 OUTLIER Glycine 0 CA--C 1.539 1.579 0 N-CA-C 110.978 -0.849 . . . . 0.0 110.978 179.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -77.87 113.98 3.55 Favored 'Trans proline' 0 N--CA 1.496 1.639 0 C-N-CA 122.518 2.145 . . . . 0.0 110.966 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 166' ' ' LEU . . . . . 0.547 ' O ' HD12 ' B' ' 166' ' ' LEU . 0.3 OUTLIER -164.98 158.29 14.29 Favored Pre-proline 0 C--N 1.325 -0.462 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.711 -178.663 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_endo -61.08 -172.02 0.08 OUTLIER 'Trans proline' 0 N--CA 1.496 1.621 0 C-N-CA 122.871 2.381 . . . . 0.0 112.1 178.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 168' ' ' VAL . . . . . 0.554 ' O ' ' N ' ' B' ' 171' ' ' LEU . 47.1 t -75.39 -62.85 1.18 Allowed 'Isoleucine or valine' 0 C--O 1.224 -0.282 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.504 -179.786 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 169' ' ' THR . . . . . 0.423 ' C ' ' O ' ' B' ' 168' ' ' VAL . 17.3 m -34.58 -48.72 0.38 Allowed 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 121.126 0.488 . . . . 0.0 110.624 -179.157 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -62.44 -44.14 97.14 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.285 178.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 171' ' ' LEU . . . . . 0.602 HD23 ' O ' ' B' ' 171' ' ' LEU . 1.2 tt -62.37 -39.32 92.79 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.226 0.536 . . . . 0.0 109.812 -179.819 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 172' ' ' ALA . . . . . . . . . . . . . . . -60.7 -42.29 96.91 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.328 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -62.25 -43.02 99.78 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.112 179.777 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -66.76 -54.54 21.78 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.587 -0.445 . . . . 0.0 110.931 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 175' ' ' ILE . . . . . 0.687 ' O ' HG23 ' B' ' 175' ' ' ILE . 8.8 tt -176.97 86.97 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.456 -0.147 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.719 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 176' ' ' GLY . . . . . 0.533 ' O ' ' N ' ' B' ' 178' ' ' GLU . . . -157.56 -49.0 0.01 OUTLIER Glycine 0 CA--C 1.522 0.471 0 N-CA-C 110.528 -1.029 . . . . 0.0 110.528 178.611 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 97.6 mtp 41.81 19.42 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.139 0 CA-C-O 120.787 0.327 . . . . 0.0 110.755 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 178' ' ' GLU . . . . . 0.533 ' N ' ' O ' ' B' ' 176' ' ' GLY . 94.3 mt-10 -150.06 67.05 0.97 Allowed 'General case' 0 CA--C 1.52 -0.195 0 CA-C-O 121.049 0.452 . . . . 0.0 109.989 -179.342 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 179' ' ' GLN . . . . . . . . . . . . . 9.1 mt-30 -57.09 -37.28 71.67 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.863 -179.64 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 180' ' ' SER . . . . . . . . . . . . . 44.5 t -61.97 -45.95 91.42 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.805 -179.76 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -61.62 -36.4 80.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.404 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 95.5 t -64.91 -50.71 73.79 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 C-N-CA 120.593 -0.443 . . . . 0.0 110.656 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 12.0 t -58.31 -45.23 88.43 Favored 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.086 -178.864 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 184' ' ' HIS . . . . . . . . . . . . . 46.6 m170 -61.67 -47.67 84.29 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-O 121.209 0.528 . . . . 0.0 110.656 179.591 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 43.2 tt0 -62.1 -40.21 95.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.234 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 186' ' ' LEU . . . . . 0.418 HD21 ' CD1' ' B' ' 206' ' ' TYR . 6.9 tp -62.63 -43.2 99.4 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.404 -179.658 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -60.2 -42.8 95.86 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.754 -0.379 . . . . 0.0 110.315 179.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 73.9 t -64.69 -54.39 30.75 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.211 0 C-N-CA 119.898 -0.721 . . . . 0.0 110.558 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 189' ' ' LEU . . . . . 0.402 HD23 ' HA ' ' B' ' 189' ' ' LEU . 98.5 mt -59.67 -40.95 89.49 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 -178.704 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 62.1 ttp180 -56.95 -42.25 79.74 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.29 179.775 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 40.6 t30 -57.03 -50.79 71.66 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.586 -0.446 . . . . 0.0 110.487 -179.671 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 192' ' ' LEU . . . . . 0.532 ' N ' HD22 ' B' ' 192' ' ' LEU . 3.9 mm? -64.45 -41.69 96.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.646 179.819 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 193' ' ' GLY . . . . . 0.419 ' C ' HD12 ' B' ' 194' ' ' LEU . . . 107.89 38.01 2.09 Favored Glycine 0 CA--C 1.524 0.613 0 N-CA-C 111.13 -0.788 . . . . 0.0 111.13 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 194' ' ' LEU . . . . . 0.506 ' N ' HD12 ' B' ' 194' ' ' LEU . 9.8 mp -97.49 -12.97 22.01 Favored 'General case' 0 N--CA 1.466 0.371 0 O-C-N 122.766 -0.255 . . . . 0.0 110.394 179.355 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 26.2 m -137.21 156.23 33.43 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.384 0 N-CA-C 109.981 -0.378 . . . . 0.0 109.981 -179.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 196' ' ' VAL . . . . . . . . . . . . . 29.9 t -141.42 152.55 19.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.451 179.583 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 197' ' ' GLY . . . . . . . . . . . . . . . -112.1 160.65 13.06 Favored Glycine 0 CA--C 1.522 0.509 0 N-CA-C 110.379 -1.088 . . . . 0.0 110.379 179.365 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 95.3 m-20 -132.13 145.55 51.46 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 62.2 ttp180 -110.16 133.84 52.81 Favored 'General case' 0 N--CA 1.466 0.367 0 O-C-N 123.4 0.438 . . . . 0.0 110.431 179.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 200' ' ' ALA . . . . . . . . . . . . . . . -145.45 132.53 20.36 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.389 179.909 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 201' ' ' GLY . . . . . . . . . . . . . . . 47.15 -104.45 0.08 OUTLIER Glycine 0 CA--C 1.522 0.528 0 N-CA-C 110.511 -1.036 . . . . 0.0 110.511 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 202' ' ' ARG . . . . . . . . . . . . . 68.2 ttt-85 -128.61 47.17 2.48 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 121.093 0.473 . . . . 0.0 109.967 179.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 85.8 p -164.92 166.87 19.15 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 121.036 0.445 . . . . 0.0 109.982 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 204' ' ' ILE . . . . . 0.619 ' C ' HD12 ' B' ' 204' ' ' ILE . 1.0 OUTLIER -141.34 158.21 22.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.546 179.53 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 205' ' ' VAL . . . . . 0.61 ' N ' HD12 ' B' ' 204' ' ' ILE . 12.3 m -134.54 157.17 41.17 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.327 179.119 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 206' ' ' TYR . . . . . 0.589 ' O ' HD11 ' B' ' 161' ' ' LEU . 79.7 m-85 -108.53 137.22 46.84 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.303 -179.813 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 40.1 t -150.75 169.93 20.45 Favored 'General case' 0 C--O 1.222 -0.391 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 208' ' ' LEU . . . . . 0.427 HD22 ' N ' ' B' ' 208' ' ' LEU . 4.4 mm? -62.27 153.69 29.96 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.718 179.23 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -50.51 -46.77 57.37 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.479 179.761 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 210' ' ' ASP . . . . . 0.523 ' OD2' ' CG ' ' B' ' 212' ' ' HIS . 31.5 t70 -156.42 166.14 34.3 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.911 0.386 . . . . 0.0 110.485 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 211' ' ' THR . . . . . 0.561 ' O ' ' HB3' ' B' ' 214' ' ' ALA . 74.1 p -67.27 -32.09 72.87 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.622 -179.773 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 212' ' ' HIS . . . . . 0.523 ' CG ' ' OD2' ' B' ' 210' ' ' ASP . 29.9 m170 -39.46 -67.49 0.22 Allowed 'General case' 0 C--O 1.238 0.457 0 CA-C-O 121.308 0.575 . . . . 0.0 110.779 -179.936 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 59.3 t -45.99 -39.24 3.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.336 179.561 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 214' ' ' ALA . . . . . 0.561 ' HB3' ' O ' ' B' ' 211' ' ' THR . . . -62.49 -38.18 88.87 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.339 179.83 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 57.5 tt0 -60.44 -44.89 95.36 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.247 0.546 . . . . 0.0 109.994 -179.743 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 216' ' ' LEU . . . . . 0.524 ' CD1' ' N ' ' B' ' 216' ' ' LEU . 6.3 mp -61.99 -45.73 92.35 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-O 121.431 0.634 . . . . 0.0 110.39 -179.567 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 67.1 mt -66.55 -34.97 79.09 Favored 'General case' 0 C--O 1.218 -0.571 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.118 179.444 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -60.07 -42.67 95.06 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 -179.735 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 219' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -64.6 -47.79 77.3 Favored 'General case' 0 CA--C 1.52 -0.187 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 179.429 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 220' ' ' ALA . . . . . 0.414 ' HA ' HD21 ' A' ' 97' ' ' LEU . . . -62.94 -44.42 96.11 Favored 'General case' 0 CA--C 1.518 -0.262 0 C-N-CA 120.643 -0.423 . . . . 0.0 111.098 179.28 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 221' ' ' ILE . . . . . . . . . . . . . 5.2 mm -63.93 -45.68 96.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 C-N-CA 120.729 -0.388 . . . . 0.0 110.98 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 89.7 t80 -63.65 -50.35 69.65 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.564 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 223' ' ' HIS . . . . . . . . . . . . . 52.0 t-80 -60.58 -33.34 72.58 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.691 -179.721 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 10.6 t -76.4 -50.79 13.26 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.918 0.39 . . . . 0.0 111.501 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -64.34 -24.16 67.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.705 -179.793 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 32.9 t60 -58.15 -72.39 0.09 Allowed 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.552 -0.459 . . . . 0.0 110.476 -179.18 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 227' ' ' LEU . . . . . . . . . . . . . 46.9 mt -80.44 -47.22 14.68 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.98 0.419 . . . . 0.0 110.48 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 228' ' ' HIS . . . . . 0.416 ' ND1' ' O ' ' B' ' 228' ' ' HIS . 53.2 t-80 44.94 51.52 8.62 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.792 -179.904 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 229' ' ' LEU . . . . . . . . . . . . . 66.6 mt -62.95 -41.68 99.58 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.61 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . 88.27 -105.17 3.11 Favored Glycine 0 CA--C 1.525 0.666 0 N-CA-C 110.911 -0.876 . . . . 0.0 110.911 -179.907 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 231' ' ' LEU . . . . . 0.59 ' N ' HD12 ' B' ' 231' ' ' LEU . 9.9 mp 42.49 61.07 2.15 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.873 0.368 . . . . 0.0 110.585 -179.881 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 232' ' ' SER . . . . . . . . . . . . . 49.9 m -62.37 -43.15 99.5 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.57 179.83 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 233' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 54.14 28.2 8.67 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.518 -179.844 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 234' ' ' ARG . . . . . . . . . . . . . 89.4 mtm180 -143.02 13.38 1.85 Allowed 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.756 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 235' ' ' HIS . . . . . 0.62 ' N ' ' CD ' ' B' ' 236' ' ' PRO . 0.9 OUTLIER -66.45 -41.81 43.34 Favored Pre-proline 0 C--N 1.327 -0.396 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.496 179.657 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 236' ' ' PRO . . . . . 0.62 ' CD ' ' N ' ' B' ' 235' ' ' HIS . 35.5 Cg_exo -60.02 144.12 99.5 Favored 'Trans proline' 0 C--N 1.309 -1.507 0 C-N-CA 122.599 2.199 . . . . 0.0 112.013 -179.172 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 237' ' ' SER . . . . . 0.404 ' O ' ' O ' ' B' ' 238' ' ' ALA . 19.5 m -61.31 -40.6 94.79 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.306 179.53 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 238' ' ' ALA . . . . . 0.404 ' O ' ' O ' ' B' ' 237' ' ' SER . . . 46.82 96.09 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.527 -179.86 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.723 0 CA-C-O 117.953 -1.471 . . . . 0.0 110.911 -179.976 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.26 0 N-CA-C 109.529 -1.429 . . . . 0.0 109.529 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 98.8 m-70 41.68 -118.38 0.41 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.725 0.298 . . . . 0.0 110.618 -179.9 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 66.44 32.29 81.36 Favored Glycine 0 CA--C 1.524 0.631 0 N-CA-C 110.911 -0.876 . . . . 0.0 110.911 179.813 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 34.7 m -72.58 131.63 34.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.924 0.392 . . . . 0.0 110.486 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 16.3 mm-40 -89.85 -172.83 3.68 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.448 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . 0.54 ' O ' ' N ' ' A' ' 9' ' ' ASN . . . -162.56 -117.24 0.41 Allowed Glycine 0 CA--C 1.522 0.485 0 N-CA-C 110.887 -0.885 . . . . 0.0 110.887 -179.876 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.401 ' O ' ' O ' ' A' ' 9' ' ' ASN . 77.1 ttt180 40.84 -90.3 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.628 0.252 . . . . 0.0 110.764 -179.701 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.54 ' N ' ' O ' ' A' ' 7' ' ' GLY . 13.7 m120 45.71 -171.29 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.542 179.829 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 66.2 mtt85 56.58 75.87 0.54 Allowed Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.539 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_exo -60.31 143.95 99.5 Favored 'Trans proline' 0 C--N 1.306 -1.687 0 C-N-CA 122.881 2.387 . . . . 0.0 112.013 179.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 48.3 p 42.59 73.87 0.13 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.718 179.767 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.629 ' N ' ' CD ' ' A' ' 14' ' ' PRO . . . -100.62 -41.06 0.22 Allowed Pre-proline 0 N--CA 1.466 0.357 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.653 179.83 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.629 ' CD ' ' N ' ' A' ' 13' ' ' ALA . 24.5 Cg_exo -62.32 32.44 0.07 OUTLIER 'Trans proline' 0 C--N 1.309 -1.521 0 C-N-CA 122.952 2.435 . . . . 0.0 112.122 -179.806 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.519 ' H ' ' C ' ' A' ' 13' ' ' ALA . 63.1 mt -64.87 136.2 56.59 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 110.052 -0.351 . . . . 0.0 110.052 -179.846 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.431 ' O ' ' OD1' ' A' ' 16' ' ' ASP . 66.8 t0 -34.0 -33.05 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.273 0 O-C-N 123.533 0.521 . . . . 0.0 110.769 -179.669 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.49 ' N ' ' O ' ' A' ' 15' ' ' LEU . 83.8 p -45.25 -50.78 11.49 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.147 179.246 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -63.44 -42.18 98.66 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.078 179.739 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.463 ' O ' HG23 ' A' ' 23' ' ' VAL . . . -57.49 -35.57 70.38 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.25 179.714 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.64 -53.47 33.69 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 110.181 -0.303 . . . . 0.0 110.181 179.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.46 -40.42 94.44 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.682 -179.644 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -61.33 -52.42 64.74 Favored 'General case' 0 C--O 1.242 0.704 0 CA-C-O 121.265 0.555 . . . . 0.0 110.48 -179.883 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.463 HG23 ' O ' ' A' ' 19' ' ' ALA . 83.5 t -62.18 -46.19 97.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.052 179.616 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -52.93 -43.63 66.41 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 120.87 -0.332 . . . . 0.0 110.207 179.748 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.9 t -59.16 -43.23 92.08 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.234 -0.439 . . . . 0.0 109.927 179.879 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 97.2 m -62.43 -51.47 67.41 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 120.539 -0.464 . . . . 0.0 110.532 179.729 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.46 ' N ' ' CD1' ' A' ' 27' ' ' LEU . 7.5 mp -65.51 -20.46 66.35 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 116.563 -0.289 . . . . 0.0 110.68 179.61 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.516 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 58.8 tt0 -74.04 -60.99 2.01 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.504 179.577 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.447 ' HB1' HH12 ' A' ' 35' ' ' ARG . . . -59.68 -54.43 46.53 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.802 -179.385 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.531 HD13 HD13 ' A' ' 39' ' ' LEU . 4.0 mm? -47.73 -30.44 3.87 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.187 -179.205 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.516 ' HB3' ' O ' ' A' ' 28' ' ' GLN . . . -58.9 -141.4 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.231 0.539 . . . . 0.0 110.453 179.661 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.407 ' O ' ' O ' ' A' ' 31' ' ' ALA . 3.3 m 59.48 115.76 0.02 OUTLIER Pre-proline 0 CA--C 1.541 0.609 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.149 -179.882 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -47.86 -53.15 7.02 Favored 'Trans proline' 0 C--N 1.31 -1.486 0 C-N-CA 122.306 2.004 . . . . 0.0 113.34 -179.068 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 78.0 p -53.01 -48.17 67.75 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.085 -178.576 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.447 HH12 ' HB1' ' A' ' 29' ' ' ALA . 82.8 mtp180 -67.77 -37.88 82.68 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 120.812 -0.355 . . . . 0.0 110.497 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.498 HD13 ' O ' ' A' ' 36' ' ' LEU . 0.2 OUTLIER -60.74 -52.76 63.73 Favored 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 120.25 -0.58 . . . . 0.0 110.86 -178.289 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.615 ' SD ' HD11 ' A' ' 56' ' ' ILE . 5.3 ttt -62.06 -48.12 81.67 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.755 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 94.7 mt -60.63 -45.65 97.04 Favored 'Isoleucine or valine' 0 C--O 1.243 0.741 0 CA-C-O 121.328 0.585 . . . . 0.0 110.481 -179.491 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.531 HD13 HD13 ' A' ' 30' ' ' LEU . 43.9 mt -60.68 -40.63 92.85 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.319 179.524 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 19.3 m -59.32 -43.17 92.71 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.024 179.062 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 67.0 tp60 -54.97 -47.03 75.1 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-O 120.984 0.421 . . . . 0.0 109.94 179.863 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.404 ' HA ' HD23 ' A' ' 42' ' ' LEU . 27.9 mt -65.89 -38.47 88.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.928 179.249 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 53.8 ttp180 -54.75 -44.08 73.3 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.09 -178.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -134.27 62.09 1.66 Allowed 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.844 0.354 . . . . 0.0 110.21 179.651 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 177.18 80.24 0.05 OUTLIER Glycine 0 CA--C 1.533 1.202 0 N-CA-C 110.686 -0.966 . . . . 0.0 110.686 -179.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -77.56 104.91 1.95 Allowed 'Trans proline' 0 N--CA 1.494 1.536 0 C-N-CA 122.491 2.128 . . . . 0.0 111.861 -179.365 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.524 ' H ' HD12 ' A' ' 47' ' ' LEU . 0.2 OUTLIER -155.88 156.43 30.54 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.342 -179.414 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -65.45 175.51 4.14 Favored 'Trans proline' 0 C--N 1.308 -1.595 0 C-N-CA 122.83 2.353 . . . . 0.0 111.975 179.633 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.545 HG23 ' N ' ' A' ' 50' ' ' THR . 5.1 m -63.91 -43.85 97.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.383 0.611 . . . . 0.0 110.994 -179.743 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.545 ' N ' HG23 ' A' ' 49' ' ' VAL . 0.2 OUTLIER -58.08 -65.78 0.59 Allowed 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.359 -179.718 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.467 ' H ' HG23 ' A' ' 50' ' ' THR . 41.2 t0 -50.68 -36.49 36.14 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 -179.61 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 9.5 tt -63.12 -41.51 99.34 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.31 179.317 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.26 -42.76 99.62 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-O 120.896 0.379 . . . . 0.0 110.241 -179.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -62.41 -41.72 98.9 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.113 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -66.68 -52.94 39.05 Favored 'General case' 0 CA--C 1.521 -0.157 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.847 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.718 HG23 ' O ' ' A' ' 56' ' ' ILE . 7.7 tt -175.07 84.1 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.881 -179.871 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -167.01 -59.29 0.03 OUTLIER Glycine 0 CA--C 1.525 0.688 0 N-CA-C 110.523 -1.031 . . . . 0.0 110.523 178.684 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 70.7 mtm 54.0 29.93 10.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.867 0.365 . . . . 0.0 110.451 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.522 ' O ' ' N ' ' A' ' 61' ' ' SER . 19.9 pt-20 -163.99 39.54 0.09 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.593 -179.879 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -40.54 -22.99 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.588 179.692 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.531 ' O ' ' ND1' ' A' ' 65' ' ' HIS . 78.0 p -67.84 -42.55 81.22 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.387 179.883 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.469 ' N ' ' O ' ' A' ' 59' ' ' GLU . . . -66.23 -35.15 79.68 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.313 179.539 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 92.1 t -66.99 -47.94 80.85 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.645 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 75.4 m -60.23 -43.14 96.29 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 120.926 -0.31 . . . . 0.0 110.473 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . 0.531 ' ND1' ' O ' ' A' ' 61' ' ' SER . 35.3 m80 -63.72 -49.94 71.09 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.608 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 93.9 mt-30 -63.71 -37.65 88.15 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.315 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 5.0 tt -62.28 -44.96 95.33 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.549 179.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 19.4 mmm180 -61.92 -41.93 98.5 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.839 0.352 . . . . 0.0 110.39 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 88.9 t -62.7 -55.13 25.67 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.133 0 C-N-CA 119.993 -0.683 . . . . 0.0 110.066 -179.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 81.2 mt -60.86 -35.47 76.68 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.29 -0.414 . . . . 0.0 109.948 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -57.83 -42.03 83.5 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.361 179.843 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 -59.68 -45.9 90.7 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.497 -0.481 . . . . 0.0 110.383 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.547 HD22 ' N ' ' A' ' 73' ' ' LEU . 3.9 mm? -67.87 -41.8 82.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.762 179.505 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 109.76 91.77 2.15 Favored Glycine 0 CA--C 1.522 0.531 0 N-CA-C 110.953 -0.859 . . . . 0.0 110.953 -179.66 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 55.2 tp -156.84 -25.81 0.09 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.755 0.312 . . . . 0.0 110.577 179.401 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 19.2 m -136.98 158.82 36.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.46 179.833 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.481 HG12 ' N ' ' A' ' 78' ' ' GLY . 71.5 t -143.85 157.33 16.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.393 -179.761 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.481 ' N ' HG12 ' A' ' 77' ' ' VAL . . . -124.22 143.4 14.77 Favored Glycine 0 N--CA 1.462 0.382 0 N-CA-C 110.385 -1.086 . . . . 0.0 110.385 179.169 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 -118.0 138.33 52.26 Favored 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 110.024 -0.361 . . . . 0.0 110.024 -179.557 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 52.6 ptt85 -109.12 145.67 35.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.636 179.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.443 ' HB3' ' O ' ' A' ' 84' ' ' SER . . . -150.33 144.02 25.25 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.385 179.576 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -40.95 -39.08 1.86 Allowed Glycine 0 CA--C 1.524 0.633 0 N-CA-C 110.875 -0.89 . . . . 0.0 110.875 -179.852 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -72.56 -44.39 62.16 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.924 -0.311 . . . . 0.0 110.984 179.589 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . 0.443 ' O ' ' HB3' ' A' ' 81' ' ' ALA . 3.7 m 177.74 -179.04 0.24 Allowed 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 121.064 0.459 . . . . 0.0 109.793 -178.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.632 ' C ' HD12 ' A' ' 85' ' ' ILE . 0.8 OUTLIER -116.75 153.28 18.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.905 179.636 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.626 ' N ' HD12 ' A' ' 85' ' ' ILE . 60.2 t -133.44 138.04 51.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.791 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.438 ' CE2' HD11 ' A' ' 85' ' ' ILE . 43.0 m-85 -100.38 132.9 45.5 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.298 178.795 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 48.2 t -150.73 170.97 17.93 Favored 'General case' 0 C--N 1.338 0.095 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.063 -179.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 47.2 mt -71.03 149.85 46.18 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.457 -179.718 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.421 ' O ' ' OD1' ' A' ' 91' ' ' ASP . 1.5 t80 -52.68 -51.34 60.65 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.485 -179.471 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.421 ' OD1' ' O ' ' A' ' 90' ' ' TYR . 98.9 m-20 -139.34 -171.15 3.06 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.412 -179.527 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 66.0 p -96.62 9.14 42.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.458 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 18.1 t-160 -52.39 -67.59 0.24 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.468 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 28.6 m -63.29 -34.35 66.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.34 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -56.46 -51.2 69.33 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.621 -179.839 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 -65.11 -42.92 93.54 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.26 179.781 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.605 ' CD1' ' HB2' ' B' ' 220' ' ' ALA . 14.4 tp -60.16 -46.64 89.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.169 0.509 . . . . 0.0 110.275 -179.66 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 71.2 mt -63.86 -37.98 89.4 Favored 'General case' 0 C--O 1.221 -0.415 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.251 179.515 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 66.1 t0 -59.47 -44.46 93.01 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.315 -179.705 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.445 ' O ' ' CG ' ' A' ' 104' ' ' HIS . 15.5 mm-40 -64.71 -50.22 67.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.7 -179.988 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.56 ' HB2' ' CD1' ' B' ' 216' ' ' LEU . . . -63.81 -40.45 96.66 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.415 -179.907 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 4.3 mm -63.75 -48.22 87.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.751 -179.037 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -67.11 -43.57 82.14 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.364 -179.71 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . 0.445 ' CG ' ' O ' ' A' ' 100' ' ' GLU . 58.1 m170 -62.76 -41.01 99.02 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.613 -179.422 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 23.3 t -76.21 -42.39 46.26 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.888 0.375 . . . . 0.0 110.923 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 85.0 tt0 -62.89 -28.8 70.29 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.547 -179.615 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 84.8 t60 -51.28 -69.58 0.11 Allowed 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.193 -179.073 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 9.7 tp -62.66 -41.87 99.31 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.769 -0.372 . . . . 0.0 110.3 -179.555 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' HIS . . . . . 0.541 ' CG ' ' H ' ' A' ' 110' ' ' LEU . 20.8 t60 74.21 -165.47 0.09 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.724 179.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.541 ' H ' ' CG ' ' A' ' 109' ' ' HIS . 10.3 mp -62.18 -42.53 99.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.461 -179.922 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 91.15 175.89 43.67 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 110.864 -0.894 . . . . 0.0 110.864 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.534 ' N ' HD22 ' A' ' 112' ' ' LEU . 3.9 mm? -63.39 -41.89 98.78 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.961 0.41 . . . . 0.0 110.812 -179.684 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 83.5 p -68.06 146.7 53.24 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.398 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 44.6 t0 -171.57 -90.08 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.521 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.464 ' NH1' ' CE1' ' A' ' 116' ' ' HIS . 73.1 ttp85 -76.4 138.36 40.34 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.512 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . 0.464 ' CE1' ' NH1' ' A' ' 115' ' ' ARG . 32.5 m170 49.02 59.18 17.45 Favored Pre-proline 0 C--N 1.331 -0.207 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.55 179.817 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -69.97 -21.46 32.47 Favored 'Trans proline' 0 C--N 1.307 -1.609 0 C-N-CA 122.624 2.216 . . . . 0.0 112.001 -179.741 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 19.4 m -75.67 154.24 36.66 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.56 -179.651 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -152.06 148.38 27.61 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.494 179.873 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.767 0 CA-C-O 117.923 -1.487 . . . . 0.0 110.995 179.97 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.263 0 N-CA-C 109.549 -1.421 . . . . 0.0 109.549 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 99.7 m-70 42.11 -122.32 0.59 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.717 0.294 . . . . 0.0 110.632 -179.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 123' ' ' GLY . . . . . . . . . . . . . . . 69.95 28.98 71.12 Favored Glycine 0 CA--C 1.523 0.564 0 N-CA-C 110.818 -0.913 . . . . 0.0 110.818 179.91 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 35.4 m -69.3 132.35 33.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.829 0.347 . . . . 0.0 110.565 -179.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 125' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -90.08 -172.98 3.69 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.501 179.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 126' ' ' GLY . . . . . 0.533 ' O ' ' N ' ' B' ' 128' ' ' ASN . . . -162.09 -118.3 0.46 Allowed Glycine 0 CA--C 1.522 0.53 0 N-CA-C 110.824 -0.911 . . . . 0.0 110.824 -179.936 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 127' ' ' ARG . . . . . . . . . . . . . 75.7 ttt180 41.53 -90.34 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.709 0.29 . . . . 0.0 110.804 -179.651 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 128' ' ' ASN . . . . . 0.533 ' N ' ' O ' ' B' ' 126' ' ' GLY . 14.3 m120 45.44 -169.43 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.499 179.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 129' ' ' ARG . . . . . . . . . . . . . 66.8 mtt85 54.9 76.33 0.52 Allowed Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.598 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -60.94 145.29 99.29 Favored 'Trans proline' 0 C--N 1.307 -1.65 0 C-N-CA 122.915 2.41 . . . . 0.0 111.983 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 57.6 p 42.48 72.3 0.18 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.619 179.739 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 132' ' ' ALA . . . . . 0.622 ' N ' ' CD ' ' B' ' 133' ' ' PRO . . . -98.96 -42.39 0.23 Allowed Pre-proline 0 N--CA 1.467 0.41 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.273 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 133' ' ' PRO . . . . . 0.622 ' CD ' ' N ' ' B' ' 132' ' ' ALA . 25.3 Cg_exo -62.66 37.45 0.08 OUTLIER 'Trans proline' 0 C--N 1.311 -1.418 0 C-N-CA 122.994 2.463 . . . . 0.0 112.064 -179.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 134' ' ' LEU . . . . . 0.513 ' H ' ' C ' ' B' ' 132' ' ' ALA . 84.6 mt -70.48 135.97 49.07 Favored 'General case' 0 CA--C 1.512 -0.496 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 -179.736 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 135' ' ' ASP . . . . . 0.43 ' C ' ' O ' ' B' ' 134' ' ' LEU . 67.7 t0 -33.87 -33.22 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.269 0 O-C-N 123.508 0.505 . . . . 0.0 110.668 -179.609 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 136' ' ' SER . . . . . 0.497 ' N ' ' O ' ' B' ' 134' ' ' LEU . 57.4 p -45.55 -50.82 12.69 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.252 179.107 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -63.94 -42.52 97.3 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.074 179.681 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 138' ' ' ALA . . . . . 0.496 ' O ' HG23 ' B' ' 142' ' ' VAL . . . -56.74 -35.61 68.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.207 179.832 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -66.69 -52.83 40.21 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 179.37 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -61.48 -40.33 94.14 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.71 -179.676 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -61.79 -52.02 65.92 Favored 'General case' 0 C--O 1.242 0.665 0 CA-C-O 121.233 0.54 . . . . 0.0 110.53 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 142' ' ' VAL . . . . . 0.496 HG23 ' O ' ' B' ' 138' ' ' ALA . 90.3 t -62.18 -46.12 97.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.024 179.611 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -52.89 -43.26 66.04 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 120.86 0.362 . . . . 0.0 110.256 179.693 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 144' ' ' SER . . . . . . . . . . . . . 11.6 t -59.47 -43.34 93.26 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.006 179.782 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 145' ' ' THR . . . . . . . . . . . . . 26.7 m -62.87 -50.98 68.78 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 120.586 -0.446 . . . . 0.0 110.589 179.466 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 146' ' ' LEU . . . . . 0.45 ' N ' ' CD1' ' B' ' 146' ' ' LEU . 7.7 mp -65.86 -20.56 66.28 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.69 -0.232 . . . . 0.0 110.773 179.643 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 147' ' ' GLN . . . . . 0.531 ' O ' ' HB3' ' B' ' 150' ' ' ALA . 59.3 tt0 -74.51 -59.79 2.57 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.604 179.434 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -60.43 -55.05 38.24 Favored 'General case' 0 CA--C 1.522 -0.117 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.8 -179.263 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 149' ' ' LEU . . . . . 0.514 HD13 HD13 ' B' ' 158' ' ' LEU . 3.9 mm? -47.62 -29.53 3.0 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.239 -179.341 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 150' ' ' ALA . . . . . 0.531 ' HB3' ' O ' ' B' ' 147' ' ' GLN . . . -59.33 -143.51 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.203 0.525 . . . . 0.0 110.308 179.422 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 151' ' ' THR . . . . . . . . . . . . . 2.6 m 61.67 116.06 0.02 OUTLIER Pre-proline 0 C--N 1.322 -0.602 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.167 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 152' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_exo -48.4 -52.0 9.2 Favored 'Trans proline' 0 C--N 1.31 -1.496 0 C-N-CA 122.319 2.013 . . . . 0.0 113.364 -179.011 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 78.0 p -54.64 -48.4 72.31 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.027 -178.43 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 154' ' ' ARG . . . . . . . . . . . . . 82.3 mtp180 -67.17 -37.73 84.22 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 120.853 -0.339 . . . . 0.0 110.588 -179.824 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 155' ' ' LEU . . . . . 0.518 ' O ' HD13 ' B' ' 155' ' ' LEU . 0.2 OUTLIER -60.73 -53.39 57.95 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 120.431 -0.508 . . . . 0.0 110.802 -178.491 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 156' ' ' MET . . . . . 0.568 ' SD ' HD11 ' B' ' 175' ' ' ILE . 4.5 ttt -61.06 -47.14 87.71 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.782 -179.851 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 96.1 mt -61.47 -44.56 98.77 Favored 'Isoleucine or valine' 0 C--O 1.243 0.749 0 CA-C-O 121.399 0.618 . . . . 0.0 110.356 -179.574 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 158' ' ' LEU . . . . . 0.514 HD13 HD13 ' B' ' 149' ' ' LEU . 33.7 mt -61.89 -40.13 94.35 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.151 179.901 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 159' ' ' THR . . . . . . . . . . . . . 16.2 m -60.47 -41.53 94.34 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.055 -0.521 . . . . 0.0 109.829 179.386 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 68.2 tp60 -57.06 -46.86 82.13 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.918 179.943 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 161' ' ' LEU . . . . . 0.421 HD23 ' HA ' ' B' ' 161' ' ' LEU . 32.6 mt -66.26 -38.6 88.22 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.836 179.376 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 162' ' ' ARG . . . . . 0.41 HH12 HG13 ' B' ' 221' ' ' ILE . 55.9 ttp180 -55.12 -43.76 74.39 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.226 -178.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 163' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -134.67 64.59 1.59 Allowed 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.948 0.404 . . . . 0.0 110.204 179.704 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 164' ' ' GLY . . . . . . . . . . . . . . . 173.8 77.58 0.05 OUTLIER Glycine 0 CA--C 1.531 1.037 0 N-CA-C 110.774 -0.931 . . . . 0.0 110.774 -179.762 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 165' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -75.35 106.4 2.26 Favored 'Trans proline' 0 N--CA 1.494 1.536 0 C-N-CA 122.547 2.165 . . . . 0.0 111.677 -179.541 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 166' ' ' LEU . . . . . 0.537 ' O ' HD12 ' B' ' 166' ' ' LEU . 0.3 OUTLIER -158.41 154.45 23.58 Favored Pre-proline 0 C--N 1.325 -0.5 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.425 -179.342 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 167' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -64.6 176.89 2.51 Favored 'Trans proline' 0 C--N 1.309 -1.52 0 C-N-CA 122.834 2.356 . . . . 0.0 112.218 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 168' ' ' VAL . . . . . 0.571 HG23 ' N ' ' B' ' 169' ' ' THR . 4.3 m -67.51 -45.52 85.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.885 -179.815 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 169' ' ' THR . . . . . 0.571 ' N ' HG23 ' B' ' 168' ' ' VAL . 0.0 OUTLIER -57.63 -41.35 81.17 Favored 'General case' 0 C--O 1.246 0.9 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.349 -179.632 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 38.0 t0 -72.67 -37.81 67.81 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.527 178.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 171' ' ' LEU . . . . . . . . . . . . . 8.6 tt -64.39 -38.41 90.92 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.171 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 172' ' ' ALA . . . . . . . . . . . . . . . -63.81 -45.31 90.2 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.264 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 173' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -60.91 -42.37 97.93 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.342 -0.543 . . . . 0.0 110.292 179.67 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -67.7 -52.28 39.61 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.927 -179.463 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 175' ' ' ILE . . . . . 0.695 ' O ' HG23 ' B' ' 175' ' ' ILE . 4.8 tt -174.57 85.7 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.771 -179.745 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 176' ' ' GLY . . . . . . . . . . . . . . . -168.71 -61.38 0.03 OUTLIER Glycine 0 C--N 1.315 -0.596 0 N-CA-C 110.527 -1.029 . . . . 0.0 110.527 178.532 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 177' ' ' MET . . . . . . . . . . . . . 64.5 mtm 56.17 29.61 15.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.792 0.329 . . . . 0.0 110.492 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 178' ' ' GLU . . . . . 0.525 ' O ' ' N ' ' B' ' 180' ' ' SER . 20.8 pt-20 -163.19 39.93 0.1 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.625 -179.816 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 179' ' ' GLN . . . . . 0.406 ' HG2' ' H ' ' B' ' 179' ' ' GLN . 1.1 pt20 -40.75 -22.4 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.561 179.738 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 180' ' ' SER . . . . . 0.525 ' N ' ' O ' ' B' ' 178' ' ' GLU . 77.3 p -68.41 -42.68 78.65 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.383 179.686 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 181' ' ' ALA . . . . . 0.478 ' N ' ' O ' ' B' ' 178' ' ' GLU . . . -66.16 -35.56 80.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.348 179.556 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 182' ' ' VAL . . . . . . . . . . . . . 99.0 t -66.96 -48.07 80.53 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.643 179.884 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 183' ' ' SER . . . . . . . . . . . . . 69.6 m -60.02 -43.44 95.27 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.841 0.353 . . . . 0.0 110.517 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 184' ' ' HIS . . . . . 0.512 ' ND1' ' O ' ' B' ' 180' ' ' SER . 33.8 m80 -63.37 -50.27 70.56 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-O 121.155 0.502 . . . . 0.0 110.739 -179.817 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 185' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 -63.62 -36.83 85.11 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.41 179.667 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 5.6 tt -62.47 -44.51 96.23 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.548 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 187' ' ' ARG . . . . . . . . . . . . . 19.0 mmm180 -62.73 -42.15 99.52 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.863 0.363 . . . . 0.0 110.412 -179.833 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . . 71.5 t -62.13 -55.5 23.68 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 C-N-CA 119.989 -0.684 . . . . 0.0 110.066 -179.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 83.8 mt -60.67 -34.78 74.83 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.809 -0.441 . . . . 0.0 109.809 -179.629 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 190' ' ' ARG . . . . . . . . . . . . . 76.3 ttt180 -58.13 -42.12 85.15 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.43 179.783 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 191' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -60.42 -46.47 89.91 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.582 -0.447 . . . . 0.0 110.445 -179.867 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 192' ' ' LEU . . . . . 0.538 ' N ' HD22 ' B' ' 192' ' ' LEU . 3.9 mm? -66.97 -41.69 86.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.658 179.56 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 109.14 93.38 2.27 Favored Glycine 0 CA--C 1.522 0.471 0 N-CA-C 110.85 -0.9 . . . . 0.0 110.85 -179.631 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 194' ' ' LEU . . . . . . . . . . . . . 52.3 tp -158.83 -25.27 0.08 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.845 0.355 . . . . 0.0 110.542 179.491 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 24.1 m -137.95 159.82 33.35 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.346 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.407 179.85 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 196' ' ' VAL . . . . . 0.519 HG12 ' N ' ' B' ' 197' ' ' GLY . 73.8 t -145.35 159.16 13.13 Favored 'Isoleucine or valine' 0 C--O 1.232 0.137 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.361 -179.873 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 197' ' ' GLY . . . . . 0.519 ' N ' HG12 ' B' ' 196' ' ' VAL . . . -125.97 143.41 14.41 Favored Glycine 0 N--CA 1.463 0.45 0 N-CA-C 110.463 -1.055 . . . . 0.0 110.463 179.34 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 198' ' ' ASP . . . . . . . . . . . . . 95.1 m-20 -117.27 138.49 51.7 Favored 'General case' 0 CA--C 1.514 -0.406 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 -179.57 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 52.7 ptt85 -108.52 144.51 36.08 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.798 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 200' ' ' ALA . . . . . 0.489 ' HB3' ' O ' ' B' ' 203' ' ' SER . . . -149.07 144.16 26.51 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.338 179.704 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 201' ' ' GLY . . . . . . . . . . . . . . . -41.33 -40.03 2.49 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 110.844 -0.902 . . . . 0.0 110.844 -179.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 202' ' ' ARG . . . . . . . . . . . . . 84.1 mtp180 -71.75 -44.6 63.79 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.921 -0.312 . . . . 0.0 110.889 179.628 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 203' ' ' SER . . . . . 0.489 ' O ' ' HB3' ' B' ' 200' ' ' ALA . 3.7 m 178.0 -179.57 0.28 Allowed 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 121.072 0.463 . . . . 0.0 109.813 -178.944 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 204' ' ' ILE . . . . . 0.588 HD11 ' CE2' ' B' ' 206' ' ' TYR . 0.9 OUTLIER -116.07 152.88 17.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 116.046 -0.524 . . . . 0.0 109.812 179.592 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 205' ' ' VAL . . . . . 0.537 ' N ' HD12 ' B' ' 204' ' ' ILE . 62.2 t -132.25 137.63 54.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.63 179.563 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 206' ' ' TYR . . . . . 0.588 ' CE2' HD11 ' B' ' 204' ' ' ILE . 46.5 m-85 -100.8 132.63 46.1 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.205 178.886 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 207' ' ' SER . . . . . . . . . . . . . 43.2 t -150.97 171.12 17.79 Favored 'General case' 0 C--O 1.231 0.093 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.197 -179.741 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . 41.7 mt -70.59 150.84 45.65 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.384 -179.576 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 209' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -53.85 -51.76 62.55 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.657 -0.417 . . . . 0.0 110.462 -179.63 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -138.87 -174.86 3.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.273 -179.372 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 211' ' ' THR . . . . . . . . . . . . . 68.2 p -92.6 7.99 40.96 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.451 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 212' ' ' HIS . . . . . . . . . . . . . 18.8 t-160 -51.11 -68.38 0.17 Allowed 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.039 0.447 . . . . 0.0 110.47 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 213' ' ' VAL . . . . . . . . . . . . . 25.1 m -62.9 -32.87 57.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.295 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 214' ' ' ALA . . . . . . . . . . . . . . . -58.05 -50.37 73.68 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.594 -179.812 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -65.59 -43.17 90.54 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.212 179.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 216' ' ' LEU . . . . . 0.56 ' CD1' ' HB2' ' A' ' 101' ' ' ALA . 15.1 tp -60.24 -46.1 90.96 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.339 -179.526 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 217' ' ' LEU . . . . . . . . . . . . . 79.3 mt -64.13 -38.55 91.46 Favored 'General case' 0 C--O 1.221 -0.406 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.332 179.373 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 218' ' ' ASP . . . . . . . . . . . . . 63.9 t0 -59.45 -45.01 92.81 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.477 -179.879 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 219' ' ' GLU . . . . . 0.434 ' O ' ' CG ' ' B' ' 223' ' ' HIS . 15.8 mm-40 -64.23 -49.94 69.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.531 -179.921 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 220' ' ' ALA . . . . . 0.605 ' HB2' ' CD1' ' A' ' 97' ' ' LEU . . . -63.9 -40.97 97.73 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.328 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 221' ' ' ILE . . . . . 0.41 HG13 HH12 ' B' ' 162' ' ' ARG . 3.7 mm -63.45 -49.11 84.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 C-N-CA 120.639 -0.424 . . . . 0.0 110.764 -179.004 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 222' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -65.52 -44.56 86.55 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.836 0.351 . . . . 0.0 110.321 -179.799 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 223' ' ' HIS . . . . . 0.434 ' CG ' ' O ' ' B' ' 219' ' ' GLU . 62.3 m170 -61.81 -41.58 97.94 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.584 -179.485 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 224' ' ' SER . . . . . . . . . . . . . 5.5 t -75.07 -42.59 56.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.864 0.364 . . . . 0.0 111.153 179.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 80.0 tt0 -63.48 -26.86 68.91 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.462 -179.426 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 226' ' ' HIS . . . . . . . . . . . . . 85.4 t60 -52.33 -70.29 0.09 Allowed 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 120.721 -0.391 . . . . 0.0 110.054 -179.032 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 227' ' ' LEU . . . . . . . . . . . . . 9.1 tp -62.92 -40.69 98.37 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.265 -179.615 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 228' ' ' HIS . . . . . 0.563 ' CG ' ' H ' ' B' ' 229' ' ' LEU . 23.1 t60 73.89 -164.64 0.09 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.631 179.913 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 229' ' ' LEU . . . . . 0.563 ' H ' ' CG ' ' B' ' 228' ' ' HIS . 10.4 mp -62.88 -41.96 99.6 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.343 -179.975 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . 92.54 175.29 41.69 Favored Glycine 0 CA--C 1.525 0.703 0 N-CA-C 110.791 -0.924 . . . . 0.0 110.791 -179.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 231' ' ' LEU . . . . . 0.543 HD22 ' N ' ' B' ' 231' ' ' LEU . 3.7 mm? -63.79 -41.02 98.01 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.953 0.406 . . . . 0.0 110.889 -179.775 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 232' ' ' SER . . . . . . . . . . . . . 12.1 p -69.84 147.51 50.26 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.357 -179.804 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 233' ' ' ASP . . . . . . . . . . . . . 64.2 t0 -170.94 -86.5 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.523 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 234' ' ' ARG . . . . . 0.417 ' NH1' ' CE1' ' B' ' 235' ' ' HIS . 73.1 ttp85 -79.38 137.25 37.22 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.459 -179.828 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 235' ' ' HIS . . . . . 0.417 ' CE1' ' NH1' ' B' ' 234' ' ' ARG . 36.1 m170 50.95 57.8 17.15 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.585 179.791 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 236' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -68.48 -21.75 39.84 Favored 'Trans proline' 0 C--N 1.308 -1.595 0 C-N-CA 122.781 2.321 . . . . 0.0 111.938 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 237' ' ' SER . . . . . . . . . . . . . 21.5 m -75.78 153.7 36.78 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.518 -179.675 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 238' ' ' ALA . . . . . . . . . . . . . . . -151.22 151.2 31.53 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.493 179.783 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 239' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.764 0 CA-C-O 118.021 -1.433 . . . . 0.0 110.917 -179.968 . . . . . . . . 0 0 . 1 stop_ save_